A0A087Y0L0_POEFO Loading...

Zinc finger protein Pegasus

AlphaFold DB , UniProt , Accession A0A087Y0L0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 410 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46	Very low	52	Low	241 Å²	241	157.5 Å²	157.5	100%	1.187	80%	0.797	S	S	*	*				0	111.7	0	-81.4	168.7	161.1	0	0	106.4
2	E	39.9	Very low	53	Low	190 Å²	190	152.9 Å²	152.9	89%	0.888	78%	0.782	S	S	*	*			trans	-136.2	111.9	167.3	-69	-171.8	137.1	0	0	106.5	I4	E2-I4 PolarHBondContact O-N 3.45Å
3	E	44.8	Very low	54.1	Low	168 Å²	168	151.5 Å²	151.5	79%	0.785	77%	0.767	S	S	*	*			trans	-86.2	105.3	178.9	-67.3	-175.1	147.9	0	0	109	K5	E3-K5 VanDerWaalsContact C-N 3.35Å; E3-K5 PolarHBondContact O-N 3.06Å
4	I	49.8	Very low	54.8	Low	154 Å²	154	149.1 Å²	149.1	79%	0.79	75%	0.752	S	S	*	*			trans	-71.9	94.2	171.5	-57.1	177.6	0	0	0	108	E2 T6	E2-I4 PolarHBondContact O-N 3.45Å; I4-T6 HydrophobicContact CG2-CG2 4.41Å; I4-T6 PolarHBondContact O-N 3.02Å
5	K	50.6	Low	55.5	Low	177 Å²	177	147.1 Å²	147.1	77%	0.77	74%	0.737	S	S	*	*			trans	-71.5	95.6	173.1	-71	-179.3	178.7	177.1	0	109.9	E3 E7	E3-K5 VanDerWaalsContact C-N 3.35Å; E3-K5 PolarHBondContact O-N 3.06Å; K5-E7 PolarHBondContact O-N 2.95Å
6	T	52.5	Low	56.1	Low	124 Å²	124	145.6 Å²	145.6	76%	0.761	73%	0.726	S	S	*	*			trans	-76.7	107.4	165.6	52.4	0	0	0	0	109.4	I4	I4-T6 HydrophobicContact CG2-CG2 4.41Å; I4-T6 PolarHBondContact O-N 3.02Å
7	E	60.3	Low	56.8	Low	175 Å²	175	142.9 Å²	142.9	82%	0.818	71%	0.711	S	S	*	*			trans	-68.7	148.7	168.8	-65.9	-162	151.7	0	0	111	K5 V9	K5-E7 PolarHBondContact O-N 2.95Å; E7-V9 PolarHBondContact O-N 2.83Å
8	P	54.4	Low	57.3	Low	124 Å²	124	142.1 Å²	142.1	81%	0.805	70%	0.699	S	S	*	*			trans	-71.8	120	177.3	29.2	-33.4	0	0	0	110.5	D10	P8-D10 PolarHBondContact O-N 2.92Å; P8-D10 VanDerWaalsContact O-N 3.13Å
9	V	56.7	Low	57.4	Low	116 Å²	116	138.5 Å²	138.5	70%	0.703	68%	0.683	S	S	*	*			trans	-66.2	111.2	172.4	178.9	0	0	0	0	109	E7 F11	E7-V9 PolarHBondContact O-N 2.83Å; V9-F11 VanDerWaalsContact C-N 3.31Å; V9-F11 PolarHBondContact O-N 3.07Å
10	D	61.8	Low	58	Low	111 Å²	111	135.2 Å²	135.2	59%	0.594	67%	0.671	S	S	*	*			trans	-76.1	84.7	179	-168.1	-8.1	0	0	0	110.9	P8 V12 K13	P8-D10 PolarHBondContact O-N 2.92Å; P8-D10 VanDerWaalsContact O-N 3.13Å; D10-V12 PolarHBondContact O-N 3.12Å; D10-V12 PolarHBondContact OD1-N 3.38Å; D10-K13 WeakPolarHBondContact O-CB 3.43Å; D10-K13 PolarHBondContact O-N 3.22Å
11	F	55.3	Low	58.2	Low	153 Å²	153	135 Å²	135	67%	0.671	67%	0.668	S	S	*	*	H	α-helix	trans	-52.8	-22.8	-176.3	-158.3	-93.6	0	0	0	113.9	V9 F15	V9-F11 VanDerWaalsContact C-N 3.31Å; V9-F11 PolarHBondContact O-N 3.07Å; F11-F15 WeakPolarHBondContact O-CB 3.48Å; F11-F15 PolarHBondContact O-N 2.88Å
12	V	64	Low	58.7	Low	102 Å²	102	128.3 Å²	128.3	62%	0.618	63%	0.634	S	S	*	*	H	α-helix	trans	-66.5	-40.1	176.4	-176.3	0	0	0	0	110.9	D10 Q16	D10-V12 PolarHBondContact O-N 3.12Å; D10-V12 PolarHBondContact OD1-N 3.38Å; V12-Q16 WeakPolarHBondContact O-CB 3.38Å; V12-Q16 PolarHBondContact O-N 3.34Å
13	K	66.8	Low	59.5	Low	134 Å²	134	123.2 Å²	123.2	58%	0.583	62%	0.616	S	S	*	*	H	α-helix	trans	-69.6	-45.9	-177.2	-173.5	-176.3	171.3	-166.8	0	111.9	D10 F15 Q16 E17	D10-K13 WeakPolarHBondContact O-CB 3.43Å; D10-K13 PolarHBondContact O-N 3.22Å; K13-F15 VanDerWaalsContact C-N 3.31Å; K13-F15 PolarHBondContact O-N 3.36Å; K13-Q16 WeakPolarHBondContact O-CB 3.48Å; K13-Q16 PolarHBondContact O-N 3.49Å; K13-Q16 VanDerWaalsContact O-N 3.15Å; K13-E17 WeakPolarHBondContact CE-OE1 3.24Å; K13-E17 IonicContact NZ-OE1 3.89Å; K13-E17 PolarHBondContact O-N 3.44Å
14	E	64.6	Low	59.9	Low	119 Å²	119	121.4 Å²	121.4	56%	0.556	61%	0.608	S	S	*	*	H	α-helix	trans	-62.9	-38.5	178.6	-168.5	172	-150.9	0	0	111.4	E17 Y18	E14-E17 PolarHBondContact O-N 2.85Å; E14-Y18 PolarHBondContact O-N 2.94Å
15	F	64.6	Low	60.1	Low	119 Å²	119	120 Å²	120	52%	0.522	60%	0.598	S	S	.	*	H	α-helix	trans	-68.5	-35.8	173.8	-160.5	-99.4	0	0	0	112.9	F11 K13 Y18 L19	F11-F15 WeakPolarHBondContact O-CB 3.48Å; F11-F15 PolarHBondContact O-N 2.88Å; K13-F15 VanDerWaalsContact C-N 3.31Å; K13-F15 PolarHBondContact O-N 3.36Å; F15-Y18 PolarHBondContact O-N 3.23Å; F15-L19 HydrophobicContact CD1-CD1 3.95Å; F15-L19 HydrophobicContact CD1-CG 4.44Å; F15-L19 HydrophobicContact CE1-CD1 3.85Å; F15-L19 HydrophobicContact CE1-CG 4.32Å; F15-L19 WeakPolarHBondContact O-CG 3.47Å; F15-L19 PolarHBondContact O-N 3.39Å
16	Q	64.8	Low	60.1	Low	122 Å²	122	115.5 Å²	115.5	57%	0.57	59%	0.585	S	S	*	*	H	α-helix	trans	-63.4	-43.6	174	-161.6	78.8	9.2	0	0	111.3	V12 K13 L19 T20	V12-Q16 WeakPolarHBondContact O-CB 3.38Å; V12-Q16 PolarHBondContact O-N 3.34Å; K13-Q16 WeakPolarHBondContact O-CB 3.48Å; K13-Q16 PolarHBondContact O-N 3.49Å; K13-Q16 VanDerWaalsContact O-N 3.15Å; Q16-L19 PolarHBondContact O-N 3.21Å; Q16-T20 PolarHBondContact O-N 2.91Å
17	E	67.9	Low	59.8	Low	101 Å²	101	114.6 Å²	114.6	47%	0.472	58%	0.575	S	S	.	*	H	α-helix	trans	-67.2	-37.3	178.2	-71.5	174.3	-173.1	0	0	112.1	K13 E14 L19 T20 Q21	K13-E17 WeakPolarHBondContact CE-OE1 3.24Å; K13-E17 IonicContact NZ-OE1 3.89Å; K13-E17 PolarHBondContact O-N 3.44Å; E14-E17 PolarHBondContact O-N 2.85Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 2.7Å; E17-T20 PolarHBondContact O-N 3.49Å; E17-T20 PolarHBondContact O-OG1 3.16Å; E17-Q21 PolarHBondContact O-N 2.97Å
18	Y	67.3	Low	59.4	Low	127 Å²	127	113.8 Å²	113.8	50%	0.498	57%	0.573	S	S	.	*	H	α-helix	trans	-59.2	-42.3	172	-179	-97.5	0	0	0	112.8	E14 F15 Q21 Q22	E14-Y18 PolarHBondContact O-N 2.94Å; F15-Y18 PolarHBondContact O-N 3.23Å; Y18-Q21 PolarHBondContact O-N 3.2Å; Y18-Q22 HydrophobicContact CE1-CG 4.24Å; Y18-Q22 VanDerWaalsContact CE1-NE2 3.33Å; Y18-Q22 PolarHBondContact O-N 2.66Å; Y18-Q22 PolarHBondContact OH-NE2 3.1Å
19	L	59.1	Low	59.3	Low	75 Å²	75	114 Å²	114	39%	0.393	57%	0.567	S	S	.	*	H	α-helix	trans	-68.7	-33.4	178.8	-68.9	172.8	0	0	0	112.7	F15 Q16 E17 T23	F15-L19 HydrophobicContact CD1-CD1 3.95Å; F15-L19 HydrophobicContact CD1-CG 4.44Å; F15-L19 HydrophobicContact CE1-CD1 3.85Å; F15-L19 HydrophobicContact CE1-CG 4.32Å; F15-L19 WeakPolarHBondContact O-CG 3.47Å; F15-L19 PolarHBondContact O-N 3.39Å; Q16-L19 PolarHBondContact O-N 3.21Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 2.7Å; L19-T23 WeakPolarHBondContact O-CB 3.47Å; L19-T23 PolarHBondContact O-N 3.13Å; L19-T23 VanDerWaalsContact O-N 3.1Å; L19-T23 PolarHBondContact O-OG1 2.91Å
20	T	68.2	Low	58.7	Low	72 Å²	72	112.4 Å²	112.4	44%	0.442	56%	0.56	S	S	.	*	H	α-helix	trans	-70.1	-37.9	175.8	60.3	0	0	0	0	111.8	Q16 E17 T23 Q24	Q16-T20 PolarHBondContact O-N 2.91Å; E17-T20 PolarHBondContact O-N 3.49Å; E17-T20 PolarHBondContact O-OG1 3.16Å; T20-T23 WeakPolarHBondContact O-CB 3.36Å; T20-T23 PolarHBondContact O-N 2.92Å; T20-Q24 WeakPolarHBondContact O-CG 3.26Å; T20-Q24 PolarHBondContact O-N 3.45Å
21	Q	63.4	Low	57.4	Low	131 Å²	131	109.9 Å²	109.9	61%	0.612	56%	0.561	S	S	*	*	H	α-helix	trans	-63.2	-44.5	174.6	-69.9	-175.6	9.5	0	0	112.6	E17 Y18 T23 Q24 H25	E17-Q21 PolarHBondContact O-N 2.97Å; Y18-Q21 PolarHBondContact O-N 3.2Å; Q21-T23 VanDerWaalsContact C-N 3.29Å; Q21-T23 PolarHBondContact O-N 2.66Å; Q21-Q24 PolarHBondContact O-N 2.83Å; Q21-H25 PolarHBondContact O-N 3.04Å; Q21-H25 VanDerWaalsContact O-N 3.12Å
22	Q	56.3	Low	56.6	Low	100 Å²	100	107.8 Å²	107.8	47%	0.467	57%	0.565	S	S	.	*	H	α-helix	trans	-59.9	-40.8	172.9	-74.2	-157	0	0	0	112.1	Y18 Q24 H25 V26	Y18-Q22 HydrophobicContact CE1-CG 4.24Å; Y18-Q22 VanDerWaalsContact CE1-NE2 3.33Å; Y18-Q22 PolarHBondContact O-N 2.66Å; Y18-Q22 PolarHBondContact OH-NE2 3.1Å; Q22-Q24 PolarHBondContact O-N 2.73Å; Q22-H25 PolarHBondContact O-N 3.33Å; Q22-V26 WeakPolarHBondContact O-CG2 3.48Å; Q22-V26 PolarHBondContact O-N 3.15Å
23	T	55.7	Low	55.2	Low	83 Å²	83	109 Å²	109	51%	0.509	57%	0.572	S	S	.	*	H	α-helix	trans	-62.7	-41.4	179.3	-54.8	0	0	0	0	111.9	L19 T20 Q21 V26 N27	L19-T23 WeakPolarHBondContact O-CB 3.47Å; L19-T23 PolarHBondContact O-N 3.13Å; L19-T23 VanDerWaalsContact O-N 3.1Å; L19-T23 PolarHBondContact O-OG1 2.91Å; T20-T23 WeakPolarHBondContact O-CB 3.36Å; T20-T23 PolarHBondContact O-N 2.92Å; Q21-T23 VanDerWaalsContact C-N 3.29Å; Q21-T23 PolarHBondContact O-N 2.66Å; T23-V26 PolarHBondContact O-N 3.18Å; T23-N27 PolarHBondContact O-N 2.83Å; T23-N27 VanDerWaalsContact O-N 3.11Å
24	Q	54.2	Low	53.5	Low	130 Å²	130	108.3 Å²	108.3	61%	0.607	58%	0.583	S	S	*	*	H	α-helix	trans	-63.4	-42.2	175.1	-72.1	176.2	-10.8	0	0	112.2	T20 Q21 Q22 V26 N27 M28	T20-Q24 WeakPolarHBondContact O-CG 3.26Å; T20-Q24 PolarHBondContact O-N 3.45Å; Q21-Q24 PolarHBondContact O-N 2.83Å; Q22-Q24 PolarHBondContact O-N 2.73Å; Q24-V26 PolarHBondContact O-N 3.13Å; Q24-N27 PolarHBondContact O-N 3.33Å; Q24-M28 WeakPolarHBondContact O-CG 3.39Å; Q24-M28 PolarHBondContact O-N 3.33Å
25	H	52.8	Low	52	Low	125 Å²	125	105.6 Å²	105.6	58%	0.579	59%	0.587	S	S	*	*	H	α-helix	trans	-64.2	-38.1	177.9	-169.1	-95.7	0	0	0	112.7	Q21 Q22 M28 I29	Q21-H25 PolarHBondContact O-N 3.04Å; Q21-H25 VanDerWaalsContact O-N 3.12Å; Q22-H25 PolarHBondContact O-N 3.33Å; H25-M28 PolarHBondContact O-N 2.9Å; H25-I29 WeakPolarHBondContact O-CG1 3.44Å; H25-I29 PolarHBondContact O-N 3.5Å
26	V	50.6	Low	50.4	Low	83 Å²	83	109.6 Å²	109.6	50%	0.503	61%	0.607	S	S	.	*	H	α-helix	trans	-67.1	-37.9	174.9	171.3	0	0	0	0	112	Q22 T23 Q24 I29 S30	Q22-V26 WeakPolarHBondContact O-CG2 3.48Å; Q22-V26 PolarHBondContact O-N 3.15Å; T23-V26 PolarHBondContact O-N 3.18Å; Q24-V26 PolarHBondContact O-N 3.13Å; V26-I29 PolarHBondContact O-N 3.47Å; V26-S30 PolarHBondContact O-N 3.48Å; V26-S30 PolarHBondContact O-OG 3.29Å
27	N	47.8	Very low	49.2	Very low	104 Å²	104	113.5 Å²	113.5	56%	0.556	62%	0.622	S	S	*	*	H	α-helix	trans	-67.8	-39	176.5	-70.6	-14.6	0	0	0	112	T23 Q24 I29 S30	T23-N27 PolarHBondContact O-N 2.83Å; T23-N27 VanDerWaalsContact O-N 3.11Å; Q24-N27 PolarHBondContact O-N 3.33Å; N27-I29 VanDerWaalsContact C-N 3.29Å; N27-I29 PolarHBondContact O-N 3.42Å; N27-S30 PolarHBondContact O-N 3.34Å; N27-S30 VanDerWaalsContact O-N 3.07Å
28	M	50.8	Low	47.4	Very low	159 Å²	159	117.6 Å²	117.6	78%	0.783	64%	0.641	S	S	*	*	H	α-helix	trans	-59.2	-37.6	172.8	-74.6	-67	-66.6	0	0	112.9	Q24 H25 S30	Q24-M28 WeakPolarHBondContact O-CG 3.39Å; Q24-M28 PolarHBondContact O-N 3.33Å; H25-M28 PolarHBondContact O-N 2.9Å; M28-S30 VanDerWaalsContact C-N 3.26Å; M28-S30 PolarHBondContact O-N 3.42Å
29	I	51.9	Low	45.5	Very low	129 Å²	129	117.7 Å²	117.7	66%	0.662	66%	0.656	S	S	*	*	H	α-helix	trans	-72.8	-19.7	177.1	-68.4	167.2	0	0	0	112.3	H25 V26 N27	H25-I29 WeakPolarHBondContact O-CG1 3.44Å; H25-I29 PolarHBondContact O-N 3.5Å; V26-I29 PolarHBondContact O-N 3.47Å; N27-I29 VanDerWaalsContact C-N 3.29Å; N27-I29 PolarHBondContact O-N 3.42Å
30	S	44	Very low	44.1	Very low	81 Å²	81	122.7 Å²	122.7	57%	0.566	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	5.2	-174.2	-54.6	0	0	0	0	114.1	V26 N27 M28 S32	V26-S30 PolarHBondContact O-N 3.48Å; V26-S30 PolarHBondContact O-OG 3.29Å; N27-S30 PolarHBondContact O-N 3.34Å; N27-S30 VanDerWaalsContact O-N 3.07Å; M28-S30 VanDerWaalsContact C-N 3.26Å; M28-S30 PolarHBondContact O-N 3.42Å; S30-S32 VanDerWaalsContact C-N 3.34Å; S30-S32 PolarHBondContact O-N 3.13Å
31	G	36	Very low	42.3	Very low	59 Å²	59	127.7 Å²	127.7	61%	0.608	70%	0.697	S	S	*	*			trans	-72.4	70.6	-175.7	0	0	0	0	0	115.3	V33	G31-V33 PolarHBondContact O-N 2.71Å; G31-V33 VanDerWaalsContact O-N 3.12Å
32	S	37	Very low	40.9	Very low	109 Å²	109	125.8 Å²	125.8	76%	0.762	70%	0.696	S	S	*	*			trans	-77.1	86.5	170.5	177.1	0	0	0	0	111.4	S30	S30-S32 VanDerWaalsContact C-N 3.34Å; S30-S32 PolarHBondContact O-N 3.13Å
33	V	34.7	Very low	39.4	Very low	127 Å²	127	131 Å²	131	77%	0.77	72%	0.718	S	S	*	*			trans	-88.8	133.3	170.6	-179.4	0	0	0	0	110.2	G31	G31-V33 PolarHBondContact O-N 2.71Å; G31-V33 VanDerWaalsContact O-N 3.12Å
34	C	32.3	Very low	38.2	Very low	120 Å²	120	135.8 Å²	135.8	81%	0.811	73%	0.734	S	S	*	*			trans	-104.8	133.2	174.3	-65	0	0	0	0	109.9
35	G	33.3	Very low	36.8	Very low	61 Å²	61	134.4 Å²	134.4	63%	0.629	75%	0.745	S	S	*	*			trans	89	154.4	-172.8	0	0	0	0	0	112.2
36	E	29.8	Very low	35.6	Very low	203 Å²	203	135 Å²	135	95%	0.949	76%	0.757	S	S	*	*			cis	-131.3	-179.3	4.5	-65.5	-174.7	112	0	0	111.3
37	K	39.7	Very low	34.7	Very low	205 Å²	205	134.9 Å²	134.9	89%	0.891	77%	0.765	S	S	*	*			trans	-94.8	135.2	179	-61.7	176.2	-179.8	177.6	0	110
38	E	29.8	Very low	33.9	Very low	186 Å²	186	136.2 Å²	136.2	87%	0.869	78%	0.779	S	S	*	*			trans	-149.7	139.8	154.7	-122.9	158	-143.4	0	0	114.6
39	T	27.6	Very low	32.8	Very low	130 Å²	130	138.5 Å²	138.5	80%	0.798	78%	0.779	S	S	*	*			trans	-0.2	138.8	169.7	50	0	0	0	0	123
40	M	29.9	Very low	31.5	Very low	180 Å²	180	138.3 Å²	138.3	89%	0.887	79%	0.788	S	S	*	*			trans	-68.9	152.7	156.7	-65.2	162.1	52.1	0	0	112.7
41	E	29.9	Very low	30.8	Very low	176 Å²	176	140.5 Å²	140.5	82%	0.822	79%	0.789	S	S	*	*			trans	-159	150.8	140	-101.9	-77.9	91.4	0	0	108.2
42	P	34.8	Very low	30.7	Very low	91 Å²	91	146.7 Å²	146.7	59%	0.591	80%	0.802	S	S	*	*			trans	-103.5	153.6	-168.6	38.2	-33.1	0	0	0	114.6
43	F	25.9	Very low	30.4	Very low	209 Å²	209	149.1 Å²	149.1	92%	0.917	81%	0.807	S	S	*	*			trans	-126.6	118.4	168.2	-85.3	-86.7	0	0	0	112.4
44	H	29.4	Very low	30.2	Very low	184 Å²	184	150 Å²	150	85%	0.852	81%	0.812	S	S	*	*			trans	-81.6	144.4	166.9	-84.7	-92.4	0	0	0	111.1
45	A	25.1	Very low	30.5	Very low	102 Å²	102	151.7 Å²	151.7	84%	0.843	81%	0.812	S	S	*	*			trans	-137.9	143.4	158.5	0	0	0	0	0	109.2
46	V	27.1	Very low	30.2	Very low	136 Å²	136	156.3 Å²	156.3	82%	0.824	82%	0.822	S	S	*	*			trans	-114.9	148.6	-174.6	173.5	0	0	0	0	110.7
47	A	32	Very low	30.4	Very low	82 Å²	82	151.6 Å²	151.6	68%	0.678	81%	0.81	S	S	*	*			trans	-31.5	167.6	177.4	0	0	0	0	0	118.7
48	P	30.8	Very low	30	Very low	131 Å²	131	148 Å²	148	85%	0.851	81%	0.807	S	S	*	*				-129.4	155.5	101.3	37.1	-32	0	0	0	115.1
49	R	28.5	Very low	30	Very low	207 Å²	207	144 Å²	144	78%	0.781	80%	0.8	S	S	*	*			trans	-69.2	156.5	164.8	-81.8	-175.8	172.2	-178.1	2.9	110.8	E51	R49-E51 IonicContact CZ-OE1 2.71Å; R49-E51 IonicContact NE-OE1 4Å; R49-E51 IonicContact NH1-OE1 2.84Å; R49-E51 PolarHBondContact NH1-OE1 3.07Å
50	C	24.8	Very low	30.8	Very low	126 Å²	126	144.3 Å²	144.3	85%	0.851	80%	0.801	S	S	*	*			trans	-132.7	141.1	143	-160.6	0	0	0	0	108.5
51	E	28.5	Very low	30.9	Very low	126 Å²	126	143.5 Å²	143.5	59%	0.589	80%	0.795	S	S	*	*			trans	-117.1	134.1	-177.9	-64.8	177.5	177.4	0	0	109.6	R49	R49-E51 IonicContact CZ-OE1 2.71Å; R49-E51 IonicContact NE-OE1 4Å; R49-E51 IonicContact NH1-OE1 2.84Å; R49-E51 PolarHBondContact NH1-OE1 3.07Å
52	Q	33.7	Very low	31.1	Very low	190 Å²	190	139 Å²	139	89%	0.888	78%	0.779	S	S	*	*			trans	-154.7	119.1	163.3	-113	158.3	26	0	0	110.5
53	N	30.4	Very low	31	Very low	160 Å²	160	139.3 Å²	139.3	86%	0.856	78%	0.784	S	S	*	*			trans	-93	126.7	174.3	-69.8	-63.8	0	0	0	109.8
54	V	30.7	Very low	31.5	Very low	144 Å²	144	134.9 Å²	134.9	87%	0.873	77%	0.769	S	S	*	*			trans	-137.9	139.1	156.4	-175.2	0	0	0	0	107.2
55	L	38.6	Very low	31.8	Very low	157 Å²	157	129.8 Å²	129.8	82%	0.822	75%	0.752	S	S	*	*			trans	-100.3	139.2	-177.9	-68.5	159.7	0	0	0	110.1
56	D	26.3	Very low	32.6	Very low	157 Å²	157	133.9 Å²	133.9	84%	0.84	76%	0.756	S	S	*	*			trans	171.9	172.1	147.2	-93	-18.4	0	0	0	109.7
57	P	34.2	Very low	33.2	Very low	105 Å²	105	134.8 Å²	134.8	68%	0.682	75%	0.752	S	S	*	*				-104.7	169.3	-106.5	3.3	22.3	0	0	0	114.2	S59	P57-S59 PolarHBondContact O-N 3.12Å
58	P	32.8	Very low	33.6	Very low	129 Å²	129	138.5 Å²	138.5	84%	0.838	76%	0.76	S	S	*	*			trans	-74.2	99.9	-166.9	29.8	-36.2	0	0	0	114.1
59	S	30.1	Very low	34.1	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	75%	0.745	S	S	*	*			trans	-82.8	136	149.4	-63.6	0	0	0	0	108.8	P57 E61	P57-S59 PolarHBondContact O-N 3.12Å; S59-E61 PolarHBondContact O-N 2.96Å
60	V	42.9	Very low	35	Very low	136 Å²	136	128.6 Å²	128.6	82%	0.824	73%	0.734	S	S	*	*			trans	-82.3	62.6	-178.1	-169	0	0	0	0	110.6	V62	V60-V62 HydrophobicContact CG1-CG2 3.96Å; V60-V62 PolarHBondContact O-N 3.11Å; V60-V62 VanDerWaalsContact O-N 3.12Å
61	E	32.2	Very low	36.3	Very low	162 Å²	162	129.6 Å²	129.6	76%	0.757	73%	0.731	S	S	*	*			trans	-66.1	99.9	161.1	-78.2	-66.5	139.7	0	0	107.8	S59 S63	S59-E61 PolarHBondContact O-N 2.96Å; E61-S63 PolarHBondContact O-N 3.13Å
62	V	34.8	Very low	37.6	Very low	81 Å²	81	125.2 Å²	125.2	49%	0.491	71%	0.711	S	S	.	*			trans	-75.8	73.1	173.8	-172.6	0	0	0	0	108.7	V60 L64	V60-V62 HydrophobicContact CG1-CG2 3.96Å; V60-V62 PolarHBondContact O-N 3.11Å; V60-V62 VanDerWaalsContact O-N 3.12Å; V62-L64 HydrophobicContact CG1-CD2 4.2Å; V62-L64 PolarHBondContact O-N 3.36Å
63	S	31.8	Very low	38.4	Very low	98 Å²	98	124.5 Å²	124.5	69%	0.685	71%	0.708	S	S	*	*			trans	-53.5	111	160.5	-70.8	0	0	0	0	107.7	E61 P65	E61-S63 PolarHBondContact O-N 3.13Å; S63-P65 WeakPolarHBondContact O-CD 3.43Å
64	L	37.2	Very low	39.5	Very low	117 Å²	117	119.2 Å²	119.2	61%	0.613	68%	0.681	S	S	*	*			trans	-77.8	107.2	173.2	-66.5	173.3	0	0	0	107.8	V62 M66	V62-L64 HydrophobicContact CG1-CD2 4.2Å; V62-L64 PolarHBondContact O-N 3.36Å; L64-M66 PolarHBondContact O-N 2.85Å
65	P	34.4	Very low	40.7	Very low	76 Å²	76	119.8 Å²	119.8	49%	0.494	67%	0.674	S	S	.	*			trans	-66.7	123	166.7	31.3	-34.2	0	0	0	107.1	S63 E67	S63-P65 WeakPolarHBondContact O-CD 3.43Å; P65-E67 HydrophobicContact CB-CG 4.02Å; P65-E67 HydrophobicContact CG-CG 4.19Å; P65-E67 PolarHBondContact O-N 3.23Å
66	M	43.7	Very low	41.3	Very low	188 Å²	188	116.9 Å²	116.9	93%	0.926	67%	0.667	S	S	*	*			trans	-78.8	66.3	166.5	-58.6	-157.4	75.5	0	0	107.9	L64	L64-M66 PolarHBondContact O-N 2.85Å
67	E	38.4	Very low	43.1	Very low	156 Å²	156	110.8 Å²	110.8	73%	0.729	63%	0.634	S	S	*	*			trans	-55.5	148.2	170.4	-69	-56.3	128.3	0	0	109.9	P65	P65-E67 HydrophobicContact CB-CG 4.02Å; P65-E67 HydrophobicContact CG-CG 4.19Å; P65-E67 PolarHBondContact O-N 3.23Å
68	D	40.1	Very low	44.4	Very low	159 Å²	159	111.1 Å²	111.1	85%	0.85	63%	0.627	S	S	*	*			trans	-56.1	144.4	-151.9	-154.4	-1	0	0	0	114.1	S70	D68-S70 PolarHBondContact O-N 2.8Å; D68-S70 VanDerWaalsContact O-N 3.12Å
69	G	42.1	Very low	46.1	Very low	52 Å²	52	113.5 Å²	113.5	54%	0.536	62%	0.619	S	S	.	*			trans	-62.9	115.9	-178.1	0	0	0	0	0	110	D71	G69-D71 VanDerWaalsContact C-N 3.29Å; G69-D71 PolarHBondContact O-N 3.23Å
70	S	47.2	Very low	48	Very low	78 Å²	78	110.2 Å²	110.2	55%	0.545	59%	0.594	S	S	.	*			trans	-63.8	97.2	164	58.5	0	0	0	0	107.8	D68 I72	D68-S70 PolarHBondContact O-N 2.8Å; D68-S70 VanDerWaalsContact O-N 3.12Å; S70-I72 PolarHBondContact O-N 2.8Å
71	D	51.5	Low	49.1	Very low	148 Å²	148	110.2 Å²	110.2	79%	0.791	60%	0.599	S	S	*	*			trans	-58	101	-174.9	-95	-32.3	0	0	0	110.4	G69 Q73	G69-D71 VanDerWaalsContact C-N 3.29Å; G69-D71 PolarHBondContact O-N 3.23Å; D71-Q73 VanDerWaalsContact C-N 3.3Å; D71-Q73 PolarHBondContact O-N 2.98Å
72	I	57.1	Low	51.2	Low	34 Å²	34	107.3 Å²	107.3	17%	0.174	59%	0.589	C	S	.	*			trans	-66.9	99.7	164.6	-54.6	-176.3	0	0	0	105.2	S70 V74 I101 I104 R105 E110	S70-I72 PolarHBondContact O-N 2.8Å; I72-V74 HydrophobicContact CG2-CG1 4.05Å; I72-V74 HydrophobicContact CG2-CG2 4.44Å; I72-V74 VanDerWaalsContact O-CG2 3.27Å; I72-V74 WeakPolarHBondContact O-CG2 3.38Å; I72-V74 PolarHBondContact O-N 3.36Å; I72-I101 HydrophobicContact CD1-CG2 4.02Å; I72-I104 HydrophobicContact CG2-CG2 4.34Å; I72-R105 HydrophobicContact CD1-CG 3.94Å; I72-E110 VanDerWaalsContact CD1-OE2 3.25Å; I72-E110 WeakPolarHBondContact CD1-OE2 3.4Å; I72-E110 WeakPolarHBondContact CG1-OE2 3.45Å
73	Q	50.3	Low	53.4	Low	174 Å²	174	105.9 Å²	105.9	81%	0.813	59%	0.591	S	S	*	*			trans	-66.6	81.2	168.5	-70.5	-176	-8.2	0	0	108.4	D71 E75	D71-Q73 VanDerWaalsContact C-N 3.3Å; D71-Q73 PolarHBondContact O-N 2.98Å; Q73-E75 PolarHBondContact O-N 3.32Å
74	V	53.6	Low	56	Low	50 Å²	50	104.8 Å²	104.8	30%	0.303	57%	0.573	S	S	.	*			trans	-74.4	67.2	172.3	-105.7	0	0	0	0	109.6	I72 S76 L77 I104	I72-V74 HydrophobicContact CG2-CG1 4.05Å; I72-V74 HydrophobicContact CG2-CG2 4.44Å; I72-V74 VanDerWaalsContact O-CG2 3.27Å; I72-V74 WeakPolarHBondContact O-CG2 3.38Å; I72-V74 PolarHBondContact O-N 3.36Å; V74-S76 PolarHBondContact O-N 2.93Å; V74-L77 HydrophobicContact CB-CD1 4.26Å; V74-L77 HydrophobicContact CG1-CD1 3.86Å; V74-I104 HydrophobicContact CG1-CD1 3.53Å
75	E	54.9	Low	58.4	Low	156 Å²	156	100.9 Å²	100.9	73%	0.729	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.1	119.2	169.7	-170.7	61.3	-102	0	0	109.4	Q73	Q73-E75 PolarHBondContact O-N 3.32Å
76	S	52.2	Low	60.9	Low	95 Å²	95	101.5 Å²	101.5	66%	0.664	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	62.3	175.6	-63.8	0	0	0	0	116.7	V74 E78	V74-S76 PolarHBondContact O-N 2.93Å; S76-E78 PolarHBondContact O-N 3.13Å
77	L	62.8	Low	63	Low	30 Å²	30	93 Å²	93	16%	0.157	51%	0.505	C	S	.	.			trans	-68.5	89.3	172.7	-156	73.4	0	0	0	112.8	V74 R79 Y85 M97 L100 I104	V74-L77 HydrophobicContact CB-CD1 4.26Å; V74-L77 HydrophobicContact CG1-CD1 3.86Å; L77-R79 PolarHBondContact O-N 3.49Å; L77-R79 VanDerWaalsContact O-N 3.13Å; L77-Y85 HydrophobicContact CD2-CD1 4.17Å; L77-M97 HydrophobicContact CD2-CB 4.38Å; L77-M97 HydrophobicContact CD2-CE 4Å; L77-M97 HydrophobicContact CD2-CG 3.81Å; L77-M97 HydrophobicContact CD2-SD 3.93Å; L77-L100 HydrophobicContact CD1-CD2 3.48Å; L77-L100 VanDerWaalsContact CD1-CD2 3.48Å; L77-L100 HydrophobicContact CD1-CG 4.15Å; L77-L100 HydrophobicContact CD2-CD2 4.04Å; L77-L100 HydrophobicContact CG-CD2 3.79Å; L77-I104 HydrophobicContact CD1-CD1 3.72Å
78	E	62.1	Low	65.3	Low	112 Å²	112	89.7 Å²	89.7	52%	0.523	50%	0.499	S	S	.	.			trans	-52.1	114.1	-174.4	-73.9	-166.6	-178.6	0	0	114.2	S76 Y85 K86	S76-E78 PolarHBondContact O-N 3.13Å; E78-Y85 WeakPolarHBondContact O-CA 3.49Å; E78-K86 HydrophobicContact CB-CB 4.34Å; E78-K86 HydrophobicContact CB-CD 4.28Å; E78-K86 PolarHBondContact O-N 3.1Å; E78-K86 WeakPolarHBondContact OE2-CD 3.32Å; E78-K86 IonicContact OE2-NZ 3.57Å; E78-K86 PolarHBondContact OE2-NZ 3.25Å
79	R	68.3	Low	67.4	Low	179 Å²	179	88.7 Å²	88.7	68%	0.675	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	127	161	-78.9	-179.3	172.6	141.4	4.4	110.1	L77 K84 Y85	L77-R79 PolarHBondContact O-N 3.49Å; L77-R79 VanDerWaalsContact O-N 3.13Å; R79-K84 WeakPolarHBondContact CA-O 3.38Å; R79-Y85 HydrophobicContact CG-CD1 3.71Å; R79-Y85 HydrophobicContact CG-CE1 3.34Å; R79-Y85 VanDerWaalsContact NE-CE1 3.3Å; R79-Y85 PolarHBondContact NE-OH 2.99Å; R79-Y85 VanDerWaalsContact NE-OH 3.09Å; R79-Y85 PolarHBondContact NH2-OH 2.95Å
80	T	69.8	Low	69.6	Low	33 Å²	33	88.6 Å²	88.6	20%	0.202	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	159	166.1	65.8	0	0	0	0	111.7	D82 G83 K84 K86	T80-D82 PolarHBondContact O-N 2.87Å; T80-D82 VanDerWaalsContact O-N 3.1Å; T80-D82 PolarHBondContact OG1-N 3.32Å; T80-G83 PolarHBondContact O-N 2.93Å; T80-K84 PolarHBondContact N-O 3.47Å; T80-K84 PolarHBondContact OG1-O 3.4Å; T80-K86 HydrophobicContact CG2-CD 3.77Å; T80-K86 VanDerWaalsContact CG2-CE 3.47Å; T80-K86 HydrophobicContact CG2-CG 3.88Å
81	C	65.8	Low	71.6	Confident	137 Å²	137	91.2 Å²	91.2	93%	0.926	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-20.7	170.1	50.5	0	0	0	0	114.3	G83	C81-G83 PolarHBondContact O-N 2.97Å
82	D	76.7	Confident	73.3	Confident	101 Å²	101	88.3 Å²	88.3	54%	0.54	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-4.4	172.1	-71.7	-27.6	0	0	0	114.3	T80 K84	T80-D82 PolarHBondContact O-N 2.87Å; T80-D82 VanDerWaalsContact O-N 3.1Å; T80-D82 PolarHBondContact OG1-N 3.32Å; D82-K84 VanDerWaalsContact C-N 3.35Å; D82-K84 HydrophobicContact CB-CB 4.49Å; D82-K84 HydrophobicContact CB-CD 3.72Å; D82-K84 HydrophobicContact CB-CG 3.86Å; D82-K84 WeakPolarHBondContact OD2-CE 3.49Å; D82-K84 IonicContact OD2-NZ 2.78Å; D82-K84 PolarHBondContact OD2-NZ 2.85Å
83	G	81.1	Confident	74.8	Confident	51 Å²	51	88.9 Å²	88.9	53%	0.526	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	35.5	-169.1	0	0	0	0	0	112.5	T80 C81	T80-G83 PolarHBondContact O-N 2.93Å; C81-G83 PolarHBondContact O-N 2.97Å
84	K	87.2	Confident	76.6	Confident	74 Å²	74	82 Å²	82	32%	0.322	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	149.2	175.1	-56.7	165.2	-169.5	156	0	109.4	R79 T80 D82 A93 N94 K95	R79-K84 WeakPolarHBondContact CA-O 3.38Å; T80-K84 PolarHBondContact N-O 3.47Å; T80-K84 PolarHBondContact OG1-O 3.4Å; D82-K84 VanDerWaalsContact C-N 3.35Å; D82-K84 HydrophobicContact CB-CB 4.49Å; D82-K84 HydrophobicContact CB-CD 3.72Å; D82-K84 HydrophobicContact CB-CG 3.86Å; D82-K84 WeakPolarHBondContact OD2-CE 3.49Å; D82-K84 IonicContact OD2-NZ 2.78Å; D82-K84 PolarHBondContact OD2-NZ 2.85Å; K84-A93 HydrophobicContact CB-CB 4.41Å; K84-N94 CarbonylContact C-O 3.57Å; K84-N94 WeakPolarHBondContact CA-O 3.29Å; K84-K95 HydrophobicContact CG-CG 4.4Å
85	Y	86.8	Confident	78.3	Confident	35 Å²	35	87.3 Å²	87.3	14%	0.137	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	131	168.3	-55.4	-87.3	0	0	0	108.6	L77 E78 R79 A93 N94 M97 L100	L77-Y85 HydrophobicContact CD2-CD1 4.17Å; E78-Y85 WeakPolarHBondContact O-CA 3.49Å; R79-Y85 HydrophobicContact CG-CD1 3.71Å; R79-Y85 HydrophobicContact CG-CE1 3.34Å; R79-Y85 VanDerWaalsContact NE-CE1 3.3Å; R79-Y85 PolarHBondContact NE-OH 2.99Å; R79-Y85 VanDerWaalsContact NE-OH 3.09Å; R79-Y85 PolarHBondContact NH2-OH 2.95Å; Y85-A93 CarbonylContact O-C 3.5Å; Y85-A93 WeakPolarHBondContact O-CA 3.42Å; Y85-A93 WeakPolarHBondContact O-CB 3.47Å; Y85-N94 PolarHBondContact N-O 3.03Å; Y85-N94 PolarHBondContact O-N 3.42Å; Y85-M97 HydrophobicContact CD1-CE 3.93Å; Y85-M97 HydrophobicContact CD1-CG 3.66Å; Y85-M97 HydrophobicContact CD2-CG 4Å; Y85-M97 HydrophobicContact CE1-CE 3.33Å; Y85-M97 HydrophobicContact CE1-CG 3.42Å; Y85-M97 VanDerWaalsContact CE1-CG 3.42Å; Y85-M97 HydrophobicContact CE1-SD 4.16Å; Y85-M97 HydrophobicContact CE2-CG 3.8Å; Y85-M97 HydrophobicContact CG-CG 3.95Å; Y85-L100 VanDerWaalsContact CB-CD2 3.41Å
86	K	87.1	Confident	79.8	Confident	89 Å²	89	81.4 Å²	81.4	39%	0.387	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	148.4	174.1	-72.9	165.3	169.5	177.9	0	111.5	E78 T80 A93 L100	E78-K86 HydrophobicContact CB-CB 4.34Å; E78-K86 HydrophobicContact CB-CD 4.28Å; E78-K86 PolarHBondContact O-N 3.1Å; E78-K86 WeakPolarHBondContact OE2-CD 3.32Å; E78-K86 IonicContact OE2-NZ 3.57Å; E78-K86 PolarHBondContact OE2-NZ 3.25Å; T80-K86 HydrophobicContact CG2-CD 3.77Å; T80-K86 VanDerWaalsContact CG2-CE 3.47Å; T80-K86 HydrophobicContact CG2-CG 3.88Å; K86-A93 HydrophobicContact CG-CB 4.33Å; K86-L100 WeakPolarHBondContact O-CD2 3.44Å
87	C	87.9	Confident	81.3	Confident	10 Å²	10	80.4 Å²	80.4	7%	0.068	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-71.8	138	164.4	-168.2	0	0	0	0	110.4	Y89 C90 Y92 L100 H103	C87-Y89 VanDerWaalsContact C-N 3.35Å; C87-Y89 PolarHBondContact SG-N 2.78Å; C87-C90 WeakPolarHBondContact CB-O 3.36Å; C87-Y92 PolarHBondContact N-O 2.7Å; C87-L100 HydrophobicContact CB-CD1 3.75Å; C87-H103 VanDerWaalsContact SG-CD2 3.5Å; C87-H103 PolarHBondContact SG-NE2 3.07Å; C87-H103 VanDerWaalsContact SG-NE2 3.35Å
88	S	85.6	Confident	82.4	Confident	87 Å²	87	82.6 Å²	82.6	61%	0.608	46%	0.458	S	S	*	.	S	Bend	trans	-70.2	-31.7	171.8	45.1	0	0	0	0	112.3
89	Y	84.9	Confident	83.5	Confident	138 Å²	138	84.8 Å²	84.8	54%	0.541	46%	0.461	S	S	.	.	S	Bend	trans	-87.2	-16.5	-175.6	-56	-79.7	0	0	0	114.7	C87 I104 H107	C87-Y89 VanDerWaalsContact C-N 3.35Å; C87-Y89 PolarHBondContact SG-N 2.78Å; Y89-I104 HydrophobicContact CE2-CG2 4.1Å; Y89-H107 HydrophobicContact CD1-CB 4.33Å; Y89-H107 HydrophobicContact CD2-CB 3.81Å; Y89-H107 AromaticContact CD2-CD2 3.98Å; Y89-H107 AromaticContact CD2-CG 3.93Å; Y89-H107 HydrophobicContact CE2-CB 4.33Å; Y89-H107 HydrophobicContact CG-CB 3.82Å; Y89-H107 AromaticContact CG-CG 3.81Å
90	C	88.6	Confident	84.5	Confident	50 Å²	50	76.2 Å²	76.2	34%	0.338	43%	0.429	S	S	.	.	S	Bend	trans	-162.3	171.6	179.9	70.7	0	0	0	0	113.2	C87 Y92 H103	C87-C90 WeakPolarHBondContact CB-O 3.36Å; C90-Y92 PolarHBondContact O-N 3.43Å; C90-H103 PolarHBondContact SG-NE2 3.25Å
91	S	89	Confident	85.3	Confident	133 Å²	133	77 Å²	77	93%	0.93	43%	0.431	S	S	*	.	S	Bend	trans	-68.7	9.9	-179.4	55.6	0	0	0	0	116.2
92	Y	87.9	Confident	86.3	Confident	87 Å²	87	72.9 Å²	72.9	34%	0.341	40%	0.399	S	S	.	.			trans	-70.6	139.2	175.4	-177.5	-101.5	0	0	0	111.7	C87 C90 N94 L100 H103	C87-Y92 PolarHBondContact N-O 2.7Å; C90-Y92 PolarHBondContact O-N 3.43Å; Y92-N94 HydrophobicContact CE1-CB 4.06Å; Y92-N94 PolarHBondContact OH-ND2 3.13Å; Y92-L100 HydrophobicContact CD1-CD1 3.87Å; Y92-L100 HydrophobicContact CE1-CD1 4.22Å; Y92-H103 HydrophobicContact CD1-CB 4.02Å; Y92-H103 AromaticContact CD1-CD2 3.55Å; Y92-H103 AromaticContact CD1-CE1 3.79Å; Y92-H103 AromaticContact CD1-CG 3.43Å; Y92-H103 VanDerWaalsContact CD1-CG 3.43Å; Y92-H103 AromaticContact CD1-ND1 3.59Å; Y92-H103 AromaticContact CD1-NE2 3.78Å; Y92-H103 HydrophobicContact CE1-CB 3.75Å; Y92-H103 AromaticContact CE1-CG 3.68Å; Y92-H103 AromaticContact CE1-ND1 3.93Å; Y92-H103 AromaticContact CG-CE1 3.66Å; Y92-H103 AromaticContact CG-ND1 3.77Å; Y92-H103 AromaticContact CG-NE2 3.9Å
93	A	89.2	Confident	86.8	Confident	45 Å²	45	69.2 Å²	69.2	37%	0.372	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	143.2	174	0	0	0	0	0	111.9	K84 Y85 K86	K84-A93 HydrophobicContact CB-CB 4.41Å; Y85-A93 CarbonylContact O-C 3.5Å; Y85-A93 WeakPolarHBondContact O-CA 3.42Å; Y85-A93 WeakPolarHBondContact O-CB 3.47Å; K86-A93 HydrophobicContact CG-CB 4.33Å
94	N	87.8	Confident	87.2	Confident	31 Å²	31	66.9 Å²	66.9	17%	0.166	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	156.5	180	-154.2	-64.2	0	0	0	111.7	K84 Y85 Y92 G96 R99	K84-N94 CarbonylContact C-O 3.57Å; K84-N94 WeakPolarHBondContact CA-O 3.29Å; Y85-N94 PolarHBondContact N-O 3.03Å; Y85-N94 PolarHBondContact O-N 3.42Å; Y92-N94 HydrophobicContact CE1-CB 4.06Å; Y92-N94 PolarHBondContact OH-ND2 3.13Å; N94-G96 PolarHBondContact OD1-N 3.4Å; N94-R99 HydrophobicContact CB-CB 4.38Å; N94-R99 WeakPolarHBondContact ND2-CB 3.46Å
95	K	87.6	Confident	87.3	Confident	161 Å²	161	66 Å²	66	70%	0.7	35%	0.348	S	S	*	.	S	Bend	trans	-78.7	-20.3	175.3	-71.4	-163.2	171.7	-158.8	0	114	K84	K84-K95 HydrophobicContact CG-CG 4.4Å
96	G	86.4	Confident	87.3	Confident	31 Å²	31	69 Å²	69	32%	0.32	37%	0.366	S	S	.	.	S	Bend	trans	-119.7	132.7	179	0	0	0	0	0	112.1	N94 A98 R99 L100	N94-G96 PolarHBondContact OD1-N 3.4Å; G96-A98 VanDerWaalsContact C-N 3.3Å; G96-A98 PolarHBondContact O-N 3.22Å; G96-R99 PolarHBondContact O-N 3Å; G96-L100 PolarHBondContact O-N 2.88Å
97	M	84.8	Confident	87.2	Confident	74 Å²	74	68.5 Å²	68.5	37%	0.365	37%	0.365	S	S	.	.	H	α-helix	trans	-52.8	-45.7	177.4	-78.2	-161.4	172.5	0	0	112.3	L77 Y85 R99 L100 I101	L77-M97 HydrophobicContact CD2-CB 4.38Å; L77-M97 HydrophobicContact CD2-CE 4Å; L77-M97 HydrophobicContact CD2-CG 3.81Å; L77-M97 HydrophobicContact CD2-SD 3.93Å; Y85-M97 HydrophobicContact CD1-CE 3.93Å; Y85-M97 HydrophobicContact CD1-CG 3.66Å; Y85-M97 HydrophobicContact CD2-CG 4Å; Y85-M97 HydrophobicContact CE1-CE 3.33Å; Y85-M97 HydrophobicContact CE1-CG 3.42Å; Y85-M97 VanDerWaalsContact CE1-CG 3.42Å; Y85-M97 HydrophobicContact CE1-SD 4.16Å; Y85-M97 HydrophobicContact CE2-CG 3.8Å; Y85-M97 HydrophobicContact CG-CG 3.95Å; M97-R99 PolarHBondContact O-N 3.3Å; M97-R99 VanDerWaalsContact O-N 3.15Å; M97-L100 CarbonylContact O-C 3.49Å; M97-L100 WeakPolarHBondContact O-CA 3.09Å; M97-L100 WeakPolarHBondContact O-CB 3.25Å; M97-L100 PolarHBondContact O-N 3.32Å; M97-I101 HydrophobicContact CB-CD1 4.45Å; M97-I101 WeakPolarHBondContact O-CG1 3.39Å; M97-I101 PolarHBondContact O-N 2.83Å
98	A	85.1	Confident	87.2	Confident	76 Å²	76	70.7 Å²	70.7	63%	0.628	38%	0.378	S	S	*	.	H	α-helix	trans	-53.5	-39.8	-178	0	0	0	0	0	113.2	G96 L100 E102	G96-A98 VanDerWaalsContact C-N 3.3Å; G96-A98 PolarHBondContact O-N 3.22Å; A98-L100 VanDerWaalsContact C-N 3.34Å; A98-E102 WeakPolarHBondContact O-CB 3.45Å; A98-E102 PolarHBondContact O-N 2.96Å
99	R	86.7	Confident	87.2	Confident	158 Å²	158	68.7 Å²	68.7	60%	0.596	37%	0.371	S	S	*	.	H	α-helix	trans	-77	-18.6	176.4	-74.1	-154.2	168.1	103.4	7.1	114.3	N94 G96 M97 H103	N94-R99 HydrophobicContact CB-CB 4.38Å; N94-R99 WeakPolarHBondContact ND2-CB 3.46Å; G96-R99 PolarHBondContact O-N 3Å; M97-R99 PolarHBondContact O-N 3.3Å; M97-R99 VanDerWaalsContact O-N 3.15Å; R99-H103 WeakPolarHBondContact O-CB 3.36Å; R99-H103 PolarHBondContact O-N 3.45Å
100	L	87.6	Confident	87.4	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-82	-40.2	170.9	-178.2	61.3	0	0	0	111.2	L77 Y85 K86 C87 Y92 G96 M97 A98 E102 H103 I104	L77-L100 HydrophobicContact CD1-CD2 3.48Å; L77-L100 VanDerWaalsContact CD1-CD2 3.48Å; L77-L100 HydrophobicContact CD1-CG 4.15Å; L77-L100 HydrophobicContact CD2-CD2 4.04Å; L77-L100 HydrophobicContact CG-CD2 3.79Å; Y85-L100 VanDerWaalsContact CB-CD2 3.41Å; K86-L100 WeakPolarHBondContact O-CD2 3.44Å; C87-L100 HydrophobicContact CB-CD1 3.75Å; Y92-L100 HydrophobicContact CD1-CD1 3.87Å; Y92-L100 HydrophobicContact CE1-CD1 4.22Å; G96-L100 PolarHBondContact O-N 2.88Å; M97-L100 CarbonylContact O-C 3.49Å; M97-L100 WeakPolarHBondContact O-CA 3.09Å; M97-L100 WeakPolarHBondContact O-CB 3.25Å; M97-L100 PolarHBondContact O-N 3.32Å; A98-L100 VanDerWaalsContact C-N 3.34Å; L100-E102 VanDerWaalsContact C-N 3.34Å; L100-H103 CarbonylContact O-C 3.5Å; L100-H103 WeakPolarHBondContact O-CA 3.37Å; L100-H103 WeakPolarHBondContact O-CB 3.48Å; L100-H103 PolarHBondContact O-N 3.01Å; L100-I104 HydrophobicContact CD1-CD1 4.44Å; L100-I104 HydrophobicContact CD1-CG1 4.46Å; L100-I104 HydrophobicContact CG-CD1 4.02Å; L100-I104 HydrophobicContact CG-CG1 4.48Å; L100-I104 WeakPolarHBondContact O-CG1 3.4Å; L100-I104 PolarHBondContact O-N 2.83Å
101	I	86.8	Confident	87.4	Confident	49 Å²	49	67.6 Å²	67.6	25%	0.251	36%	0.364	S	S	.	.	H	α-helix	trans	-60.8	-46.1	171.6	-62.1	165.4	0	0	0	109.7	I72 M97 H103 I104 R105	I72-I101 HydrophobicContact CD1-CG2 4.02Å; M97-I101 HydrophobicContact CB-CD1 4.45Å; M97-I101 WeakPolarHBondContact O-CG1 3.39Å; M97-I101 PolarHBondContact O-N 2.83Å; I101-H103 PolarHBondContact O-N 3.48Å; I101-I104 PolarHBondContact O-N 2.77Å; I101-I104 VanDerWaalsContact O-N 3.1Å; I101-R105 PolarHBondContact O-N 3.15Å
102	E	87.6	Confident	87.3	Confident	50 Å²	50	63.2 Å²	63.2	23%	0.234	33%	0.333	C	S	.	.	H	α-helix	trans	-52.5	-37.9	170.6	-173.3	-167	177.6	0	0	112.5	A98 L100 Y124 R126	A98-E102 WeakPolarHBondContact O-CB 3.45Å; A98-E102 PolarHBondContact O-N 2.96Å; L100-E102 VanDerWaalsContact C-N 3.34Å; E102-Y124 HydrophobicContact CG-CD1 3.56Å; E102-Y124 HydrophobicContact CG-CE1 3.41Å; E102-Y124 VanDerWaalsContact CG-CE1 3.41Å; E102-Y124 WeakPolarHBondContact OE1-CD1 3.43Å; E102-Y124 VanDerWaalsContact OE1-CE1 3.22Å; E102-Y124 WeakPolarHBondContact OE1-CE1 3.4Å; E102-R126 IonicContact OE1-CZ 3.88Å; E102-R126 IonicContact OE1-NH1 2.66Å; E102-R126 PolarHBondContact OE1-NH1 2.85Å; E102-R126 IonicContact OE1-NH2 2.71Å
103	H	88.2	Confident	87.5	Confident	25 Å²	25	61.4 Å²	61.4	12%	0.116	33%	0.327	C	S	.	.	H	α-helix	trans	-78	-35.2	176.1	166	89.1	0	0	0	113.3	C87 C90 Y92 R99 L100 I101 R105 I106 H107	C87-H103 VanDerWaalsContact SG-CD2 3.5Å; C87-H103 PolarHBondContact SG-NE2 3.07Å; C87-H103 VanDerWaalsContact SG-NE2 3.35Å; C90-H103 PolarHBondContact SG-NE2 3.25Å; Y92-H103 HydrophobicContact CD1-CB 4.02Å; Y92-H103 AromaticContact CD1-CD2 3.55Å; Y92-H103 AromaticContact CD1-CE1 3.79Å; Y92-H103 AromaticContact CD1-CG 3.43Å; Y92-H103 VanDerWaalsContact CD1-CG 3.43Å; Y92-H103 AromaticContact CD1-ND1 3.59Å; Y92-H103 AromaticContact CD1-NE2 3.78Å; Y92-H103 HydrophobicContact CE1-CB 3.75Å; Y92-H103 AromaticContact CE1-CG 3.68Å; Y92-H103 AromaticContact CE1-ND1 3.93Å; Y92-H103 AromaticContact CG-CE1 3.66Å; Y92-H103 AromaticContact CG-ND1 3.77Å; Y92-H103 AromaticContact CG-NE2 3.9Å; R99-H103 WeakPolarHBondContact O-CB 3.36Å; R99-H103 PolarHBondContact O-N 3.45Å; L100-H103 CarbonylContact O-C 3.5Å; L100-H103 WeakPolarHBondContact O-CA 3.37Å; L100-H103 WeakPolarHBondContact O-CB 3.48Å; L100-H103 PolarHBondContact O-N 3.01Å; I101-H103 PolarHBondContact O-N 3.48Å; H103-R105 PolarHBondContact O-N 2.94Å; H103-I106 WeakPolarHBondContact O-CB 3.42Å; H103-I106 VanDerWaalsContact O-CG1 3.23Å; H103-I106 WeakPolarHBondContact O-CG1 3.3Å; H103-I106 PolarHBondContact O-N 2.98Å; H103-H107 AromaticContact CD2-NE2 3.89Å; H103-H107 AromaticContact CE1-NE2 3.6Å; H103-H107 AromaticContact NE2-CD2 3.74Å; H103-H107 AromaticContact NE2-NE2 3.05Å; H103-H107 PolarHBondContact NE2-NE2 2.98Å
104	I	88.1	Confident	87.6	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-63.8	-31.3	-178.7	-76.6	167.6	0	0	0	111.5	I72 V74 L77 Y89 L100 I101 I106 H107 T108	I72-I104 HydrophobicContact CG2-CG2 4.34Å; V74-I104 HydrophobicContact CG1-CD1 3.53Å; L77-I104 HydrophobicContact CD1-CD1 3.72Å; Y89-I104 HydrophobicContact CE2-CG2 4.1Å; L100-I104 HydrophobicContact CD1-CD1 4.44Å; L100-I104 HydrophobicContact CD1-CG1 4.46Å; L100-I104 HydrophobicContact CG-CD1 4.02Å; L100-I104 HydrophobicContact CG-CG1 4.48Å; L100-I104 WeakPolarHBondContact O-CG1 3.4Å; L100-I104 PolarHBondContact O-N 2.83Å; I101-I104 PolarHBondContact O-N 2.77Å; I101-I104 VanDerWaalsContact O-N 3.1Å; I104-I106 PolarHBondContact O-N 2.84Å; I104-H107 PolarHBondContact O-N 2.73Å; I104-T108 HydrophobicContact CG2-CG2 4.06Å; I104-T108 PolarHBondContact O-N 2.98Å
105	R	89.1	Confident	87.8	Confident	54 Å²	54	66.9 Å²	66.9	20%	0.204	34%	0.338	C	S	.	.	H	α-helix	trans	-56.2	-19.1	170	-64.6	176.8	-179.8	173.2	-0.3	114.6	I72 I101 H103 H107 T108 G109 E110 H113 A123	I72-R105 HydrophobicContact CD1-CG 3.94Å; I101-R105 PolarHBondContact O-N 3.15Å; H103-R105 PolarHBondContact O-N 2.94Å; R105-H107 VanDerWaalsContact C-N 3.35Å; R105-T108 WeakPolarHBondContact CA-OG1 3.39Å; R105-G109 WeakPolarHBondContact O-CA 2.98Å; R105-G109 PolarHBondContact O-N 3.07Å; R105-E110 HydrophobicContact CB-CB 4.49Å; R105-E110 HydrophobicContact CG-CB 4.26Å; R105-E110 PolarHBondContact O-N 2.94Å; R105-H113 PolarHBondContact NH1-NE2 2.85Å; R105-A123 HydrophobicContact CB-CB 3.87Å; R105-A123 WeakPolarHBondContact CD-O 3.31Å; R105-A123 PolarHBondContact NH1-O 3.1Å
106	I	87.1	Confident	87.9	Confident	99 Å²	99	65.9 Å²	65.9	51%	0.508	34%	0.336	S	S	.	.	H	α-helix	trans	-70.8	-34	172.8	-54.8	171.3	0	0	0	110.7	H103 I104 Y124	H103-I106 WeakPolarHBondContact O-CB 3.42Å; H103-I106 VanDerWaalsContact O-CG1 3.23Å; H103-I106 WeakPolarHBondContact O-CG1 3.3Å; H103-I106 PolarHBondContact O-N 2.98Å; I104-I106 PolarHBondContact O-N 2.84Å; I106-Y124 WeakPolarHBondContact CD1-OH 3.34Å
107	H	85.9	Confident	88	Confident	78 Å²	78	69.8 Å²	69.8	36%	0.361	35%	0.348	S	S	.	.	H	α-helix	trans	-88	-40.9	-179.2	-56.8	-78.6	0	0	0	112.1	Y89 H103 I104 R105 G109	Y89-H107 HydrophobicContact CD1-CB 4.33Å; Y89-H107 HydrophobicContact CD2-CB 3.81Å; Y89-H107 AromaticContact CD2-CD2 3.98Å; Y89-H107 AromaticContact CD2-CG 3.93Å; Y89-H107 HydrophobicContact CE2-CB 4.33Å; Y89-H107 HydrophobicContact CG-CB 3.82Å; Y89-H107 AromaticContact CG-CG 3.81Å; H103-H107 AromaticContact CD2-NE2 3.89Å; H103-H107 AromaticContact CE1-NE2 3.6Å; H103-H107 AromaticContact NE2-CD2 3.74Å; H103-H107 AromaticContact NE2-NE2 3.05Å; H103-H107 PolarHBondContact NE2-NE2 2.98Å; I104-H107 PolarHBondContact O-N 2.73Å; R105-H107 VanDerWaalsContact C-N 3.35Å; H107-G109 VanDerWaalsContact C-N 3.3Å
108	T	86.4	Confident	88.3	Confident	57 Å²	57	67.9 Å²	67.9	35%	0.35	34%	0.342	S	S	.	.	H	α-helix	trans	-77	-16.4	176.1	64.1	0	0	0	0	113.2	I104 R105 E110	I104-T108 HydrophobicContact CG2-CG2 4.06Å; I104-T108 PolarHBondContact O-N 2.98Å; R105-T108 WeakPolarHBondContact CA-OG1 3.39Å; T108-E110 WeakPolarHBondContact CB-OE1 3.27Å; T108-E110 PolarHBondContact O-N 2.78Å; T108-E110 VanDerWaalsContact OG1-CD 3.32Å; T108-E110 WeakPolarHBondContact OG1-CG 3.37Å; T108-E110 PolarHBondContact OG1-OE1 3.26Å
109	G	86.3	Confident	88.6	Confident	45 Å²	45	71 Å²	71	46%	0.464	36%	0.356	S	S	.	.			trans	74.7	4.7	-179.7	0	0	0	0	0	114.7	R105 H107	R105-G109 WeakPolarHBondContact O-CA 2.98Å; R105-G109 PolarHBondContact O-N 3.07Å; H107-G109 VanDerWaalsContact C-N 3.3Å
110	E	88.3	Confident	88.8	Confident	47 Å²	47	67.4 Å²	67.4	22%	0.22	35%	0.345	C	S	.	.			trans	-62.1	139	-175.4	-76.8	169.3	-111	0	0	114.1	I72 R105 T108 A123	I72-E110 VanDerWaalsContact CD1-OE2 3.25Å; I72-E110 WeakPolarHBondContact CD1-OE2 3.4Å; I72-E110 WeakPolarHBondContact CG1-OE2 3.45Å; R105-E110 HydrophobicContact CB-CB 4.49Å; R105-E110 HydrophobicContact CG-CB 4.26Å; R105-E110 PolarHBondContact O-N 2.94Å; T108-E110 WeakPolarHBondContact CB-OE1 3.27Å; T108-E110 PolarHBondContact O-N 2.78Å; T108-E110 VanDerWaalsContact OG1-CD 3.32Å; T108-E110 WeakPolarHBondContact OG1-CG 3.37Å; T108-E110 PolarHBondContact OG1-OE1 3.26Å; E110-A123 VanDerWaalsContact O-CB 3.31Å; E110-A123 WeakPolarHBondContact O-CB 3.42Å
111	K	89.3	Confident	89	Confident	118 Å²	118	68.7 Å²	68.7	51%	0.513	36%	0.355	S	S	.	.			trans	-135.1	69.1	-175.9	-67.8	162.1	-174.2	174.3	0	110.8	H113 A121 S122	K111-H113 VanDerWaalsContact C-N 3.27Å; K111-H113 PolarHBondContact O-N 3.26Å; K111-A121 HydrophobicContact CB-CB 3.68Å; K111-A121 HydrophobicContact CD-CB 4.27Å; K111-A121 HydrophobicContact CG-CB 4.49Å; K111-S122 CarbonylContact C-O 3.46Å; K111-S122 WeakPolarHBondContact CA-O 3.44Å
112	P	88	Confident	89.1	Confident	41 Å²	41	66.8 Å²	66.8	27%	0.266	35%	0.346	S	S	.	.			trans	-63	-32.3	-179	22.9	-32.2	0	0	0	112.7	R114	P112-R114 PolarHBondContact O-N 2.94Å
113	H	90.6	Very high	89.1	Confident	48 Å²	48	65.1 Å²	65.1	22%	0.222	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	86.9	-178.3	-53.7	-81.6	0	0	0	110.7	R105 K111 A121 S122 E125 L128	R105-H113 PolarHBondContact NH1-NE2 2.85Å; K111-H113 VanDerWaalsContact C-N 3.27Å; K111-H113 PolarHBondContact O-N 3.26Å; H113-A121 WeakPolarHBondContact O-CA 3.48Å; H113-S122 WeakPolarHBondContact CB-O 3.25Å; H113-S122 PolarHBondContact N-O 3.26Å; H113-S122 VanDerWaalsContact N-O 3.14Å; H113-S122 PolarHBondContact O-N 2.84Å; H113-S122 PolarHBondContact O-OG 2.83Å; H113-E125 PolarHBondContact CD2-N 2.13Å; H113-E125 VanDerWaalsContact CD2-N 3.31Å; H113-E125 PolarHBondContact NE2-N 3.34Å; H113-L128 HydrophobicContact CB-CB 4.02Å; H113-L128 HydrophobicContact CB-CD2 3.91Å
114	R	91.2	Very high	89.1	Confident	178 Å²	178	66.3 Å²	66.3	67%	0.672	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	146.7	177.5	-63.2	-176.6	174.6	86.6	-4.9	112.1	P112 A121 L128	P112-R114 PolarHBondContact O-N 2.94Å; R114-A121 HydrophobicContact CB-CB 4.49Å; R114-A121 HydrophobicContact CG-CB 3.88Å; R114-L128 VanDerWaalsContact O-CD2 3.31Å; R114-L128 WeakPolarHBondContact O-CD2 3.37Å
115	C	92.3	Very high	89.2	Confident	14 Å²	14	72 Å²	72	10%	0.095	37%	0.371	C	S	.	.			trans	-81.3	141.4	169	-176.1	0	0	0	0	110.5	L117 C118 F120 L128 H131 H135	C115-L117 PolarHBondContact SG-N 3.43Å; C115-L117 VanDerWaalsContact SG-N 3.36Å; C115-C118 WeakPolarHBondContact CB-O 3.28Å; C115-F120 HydrophobicContact CB-CB 4.18Å; C115-F120 WeakPolarHBondContact CB-O 3.39Å; C115-F120 PolarHBondContact N-O 2.91Å; C115-L128 HydrophobicContact CB-CD1 3.82Å; C115-H131 PolarHBondContact SG-NE2 3.23Å; C115-H135 PolarHBondContact SG-NE2 3.36Å
116	Q	90.6	Very high	89	Confident	140 Å²	140	74.9 Å²	74.9	65%	0.654	38%	0.382	S	S	*	.	S	Bend	trans	-83.4	-20.1	175.5	-65.1	176	-4.9	0	0	112.5
117	L	89.1	Confident	89.1	Confident	112 Å²	112	73.4 Å²	73.4	59%	0.586	37%	0.373	S	S	*	.	S	Bend	trans	-98.1	-14.2	-173.4	-58	177.8	0	0	0	113.8	C115 M132 H135	C115-L117 PolarHBondContact SG-N 3.43Å; C115-L117 VanDerWaalsContact SG-N 3.36Å; L117-M132 HydrophobicContact CD1-CE 3.8Å; L117-M132 HydrophobicContact CG-CE 4.24Å; L117-H135 HydrophobicContact CD1-CB 3.67Å
118	C	91	Very high	89.3	Confident	35 Å²	35	70.8 Å²	70.8	24%	0.236	36%	0.361	C	S	.	.	S	Bend	trans	-161.7	165.9	178.3	77.5	0	0	0	0	110.6	C115 F120 H131 H135	C115-C118 WeakPolarHBondContact CB-O 3.28Å; C118-F120 PolarHBondContact O-N 2.98Å; C118-F120 VanDerWaalsContact SG-CB 3.59Å; C118-H131 VanDerWaalsContact SG-CE1 3.53Å; C118-H131 PolarHBondContact SG-NE2 3.17Å; C118-H135 WeakPolarHBondContact CB-CE1 3.41Å; C118-H135 PolarHBondContact SG-CE1 3.19Å; C118-H135 PolarHBondContact SG-NE2 3.32Å
119	P	90.2	Very high	89.5	Confident	140 Å²	140	72.6 Å²	72.6	91%	0.909	37%	0.366	S	S	*	.	S	Bend	trans	-72.2	17.6	-176.3	30.8	-37.2	0	0	0	115
120	F	90.6	Very high	89.6	Confident	84 Å²	84	71.2 Å²	71.2	37%	0.368	35%	0.35	S	S	.	.			trans	-70.1	133.6	175.1	-179	-96	0	0	0	111.1	C115 C118 H131	C115-F120 HydrophobicContact CB-CB 4.18Å; C115-F120 WeakPolarHBondContact CB-O 3.39Å; C115-F120 PolarHBondContact N-O 2.91Å; C118-F120 PolarHBondContact O-N 2.98Å; C118-F120 VanDerWaalsContact SG-CB 3.59Å; F120-H131 HydrophobicContact CD1-CB 3.89Å; F120-H131 AromaticContact CD1-CD2 3.47Å; F120-H131 VanDerWaalsContact CD1-CD2 3.47Å; F120-H131 WeakPolarHBondContact CD1-CD2 3.05Å; F120-H131 AromaticContact CD1-CG 3.39Å; F120-H131 AromaticContact CD1-ND1 3.75Å; F120-H131 AromaticContact CD1-NE2 3.87Å; F120-H131 HydrophobicContact CE1-CB 3.63Å; F120-H131 AromaticContact CE1-CG 3.68Å; F120-H131 AromaticContact CG-CD2 3.98Å; F120-H131 AromaticContact CG-CE1 3.74Å; F120-H131 AromaticContact CG-CG 3.89Å; F120-H131 AromaticContact CG-ND1 3.74Å; F120-H131 AromaticContact CG-NE2 3.89Å; F120-H131 HydrophobicContact CZ-CB 4.26Å
121	A	91.6	Very high	89.6	Confident	27 Å²	27	70.4 Å²	70.4	22%	0.223	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	146	176.4	0	0	0	0	0	110.7	K111 H113 R114	K111-A121 HydrophobicContact CB-CB 3.68Å; K111-A121 HydrophobicContact CD-CB 4.27Å; K111-A121 HydrophobicContact CG-CB 4.49Å; H113-A121 WeakPolarHBondContact O-CA 3.48Å; R114-A121 HydrophobicContact CB-CB 4.49Å; R114-A121 HydrophobicContact CG-CB 3.88Å
122	S	89.3	Confident	89.7	Confident	9 Å²	9	67.4 Å²	67.4	6%	0.063	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	152.8	-176	69.3	0	0	0	0	113	K111 H113 Y124 L128	K111-S122 CarbonylContact C-O 3.46Å; K111-S122 WeakPolarHBondContact CA-O 3.44Å; H113-S122 WeakPolarHBondContact CB-O 3.25Å; H113-S122 PolarHBondContact N-O 3.26Å; H113-S122 VanDerWaalsContact N-O 3.14Å; H113-S122 PolarHBondContact O-N 2.84Å; H113-S122 PolarHBondContact O-OG 2.83Å; S122-Y124 PolarHBondContact O-N 3.18Å; S122-Y124 PolarHBondContact OG-O 3.29Å; S122-Y124 VanDerWaalsContact OG-O 3.11Å; S122-L128 PolarHBondContact OG-N 3.03Å
123	A	88.8	Confident	89.7	Confident	14 Å²	14	67.7 Å²	67.7	12%	0.116	33%	0.331	C	S	.	.	S	Bend	trans	-73.3	-8.2	175	0	0	0	0	0	113.6	R105 E110	R105-A123 HydrophobicContact CB-CB 3.87Å; R105-A123 WeakPolarHBondContact CD-O 3.31Å; R105-A123 PolarHBondContact NH1-O 3.1Å; E110-A123 VanDerWaalsContact O-CB 3.31Å; E110-A123 WeakPolarHBondContact O-CB 3.42Å
124	Y	87.7	Confident	89.5	Confident	50 Å²	50	69 Å²	69	20%	0.196	35%	0.345	C	S	.	.	S	Bend	trans	-141.3	121.8	-166.9	-51.9	-98.1	0	0	0	112.2	E102 I106 S122 R126 H127 L128	E102-Y124 HydrophobicContact CG-CD1 3.56Å; E102-Y124 HydrophobicContact CG-CE1 3.41Å; E102-Y124 VanDerWaalsContact CG-CE1 3.41Å; E102-Y124 WeakPolarHBondContact OE1-CD1 3.43Å; E102-Y124 VanDerWaalsContact OE1-CE1 3.22Å; E102-Y124 WeakPolarHBondContact OE1-CE1 3.4Å; I106-Y124 WeakPolarHBondContact CD1-OH 3.34Å; S122-Y124 PolarHBondContact O-N 3.18Å; S122-Y124 PolarHBondContact OG-O 3.29Å; S122-Y124 VanDerWaalsContact OG-O 3.11Å; Y124-R126 VanDerWaalsContact CD1-CZ 3.43Å; Y124-R126 PolarHBondContact O-N 2.79Å; Y124-H127 AromaticContact CD2-CD2 3.68Å; Y124-H127 AromaticContact CG-CD2 3.82Å; Y124-H127 WeakPolarHBondContact O-CB 3.47Å; Y124-H127 PolarHBondContact O-N 2.99Å; Y124-L128 PolarHBondContact O-N 2.83Å
125	E	88.9	Confident	89.3	Confident	123 Å²	123	64.8 Å²	64.8	58%	0.575	33%	0.333	S	S	*	.	H	α-helix	trans	-45.5	-52.4	177.6	-169.8	-174.7	170.8	0	0	114.2	H113 H127 L128 E129	H113-E125 PolarHBondContact CD2-N 2.13Å; H113-E125 VanDerWaalsContact CD2-N 3.31Å; H113-E125 PolarHBondContact NE2-N 3.34Å; E125-H127 PolarHBondContact O-N 2.93Å; E125-L128 CarbonylContact O-C 3.44Å; E125-L128 WeakPolarHBondContact O-CA 3.36Å; E125-L128 WeakPolarHBondContact O-CB 3.44Å; E125-L128 PolarHBondContact O-N 2.87Å; E125-E129 PolarHBondContact O-N 3.44Å
126	R	86.8	Confident	89	Confident	114 Å²	114	68.3 Å²	68.3	43%	0.43	35%	0.354	S	S	.	.	H	α-helix	trans	-53.2	-24.4	176.9	66.8	174.6	-174	-95.4	-9.8	114.9	E102 Y124 A130	E102-R126 IonicContact OE1-CZ 3.88Å; E102-R126 IonicContact OE1-NH1 2.66Å; E102-R126 PolarHBondContact OE1-NH1 2.85Å; E102-R126 IonicContact OE1-NH2 2.71Å; Y124-R126 VanDerWaalsContact CD1-CZ 3.43Å; Y124-R126 PolarHBondContact O-N 2.79Å; R126-A130 VanDerWaalsContact O-CB 3.28Å; R126-A130 WeakPolarHBondContact O-CB 3.36Å; R126-A130 PolarHBondContact O-N 3.48Å; R126-A130 VanDerWaalsContact O-N 3.13Å
127	H	88.3	Confident	88.7	Confident	67 Å²	67	63.7 Å²	63.7	31%	0.31	34%	0.344	S	S	.	.	H	α-helix	trans	-90.3	-28.6	179.4	-66.6	-40.2	0	0	0	111.5	Y124 E125 H131	Y124-H127 AromaticContact CD2-CD2 3.68Å; Y124-H127 AromaticContact CG-CD2 3.82Å; Y124-H127 WeakPolarHBondContact O-CB 3.47Å; Y124-H127 PolarHBondContact O-N 2.99Å; E125-H127 PolarHBondContact O-N 2.93Å; H127-H131 VanDerWaalsContact O-CB 3.25Å; H127-H131 WeakPolarHBondContact O-CB 3.34Å; H127-H131 PolarHBondContact O-N 3.19Å; H127-H131 VanDerWaalsContact O-N 3.11Å
128	L	90.8	Very high	88.6	Confident	23 Å²	23	62.9 Å²	62.9	12%	0.12	34%	0.337	C	S	.	.	H	α-helix	trans	-66.4	-47.1	162.7	178	62.3	0	0	0	110.8	H113 R114 C115 S122 Y124 E125 A130 H131 M132	H113-L128 HydrophobicContact CB-CB 4.02Å; H113-L128 HydrophobicContact CB-CD2 3.91Å; R114-L128 VanDerWaalsContact O-CD2 3.31Å; R114-L128 WeakPolarHBondContact O-CD2 3.37Å; C115-L128 HydrophobicContact CB-CD1 3.82Å; S122-L128 PolarHBondContact OG-N 3.03Å; Y124-L128 PolarHBondContact O-N 2.83Å; E125-L128 CarbonylContact O-C 3.44Å; E125-L128 WeakPolarHBondContact O-CA 3.36Å; E125-L128 WeakPolarHBondContact O-CB 3.44Å; E125-L128 PolarHBondContact O-N 2.87Å; L128-A130 VanDerWaalsContact C-N 3.33Å; L128-A130 PolarHBondContact O-N 3.12Å; L128-H131 CarbonylContact O-C 3.58Å; L128-H131 WeakPolarHBondContact O-CA 3.44Å; L128-H131 WeakPolarHBondContact O-CB 3.28Å; L128-H131 PolarHBondContact O-N 2.98Å; L128-M132 HydrophobicContact CD1-CG 4.37Å; L128-M132 HydrophobicContact CD1-SD 4.24Å; L128-M132 HydrophobicContact CG-CG 4.46Å; L128-M132 WeakPolarHBondContact O-CG 3.4Å; L128-M132 PolarHBondContact O-N 3.38Å
129	E	89.6	Confident	88.4	Confident	96 Å²	96	66.9 Å²	66.9	45%	0.449	35%	0.351	S	S	.	.	H	α-helix	trans	-59.8	-38.9	178	-167.5	-137.4	139.6	0	0	112.6	E125 H131 R133	E125-E129 PolarHBondContact O-N 3.44Å; E129-H131 VanDerWaalsContact C-N 3.35Å; E129-R133 PolarHBondContact O-NH1 3.02Å; E129-R133 VanDerWaalsContact O-NH1 3.07Å; E129-R133 IonicContact OE1-CZ 2.7Å; E129-R133 IonicContact OE1-NH1 3.15Å; E129-R133 PolarHBondContact OE1-NH1 2.94Å; E129-R133 IonicContact OE1-NH2 3.9Å; E129-R133 PolarHBondContact OE1-NH2 2.82Å
130	A	88.1	Confident	88.2	Confident	16 Å²	16	63 Å²	63	13%	0.132	33%	0.326	C	S	.	.	H	α-helix	trans	-71.4	-27.8	172.3	0	0	0	0	0	113.3	R126 L128 D152	R126-A130 VanDerWaalsContact O-CB 3.28Å; R126-A130 WeakPolarHBondContact O-CB 3.36Å; R126-A130 PolarHBondContact O-N 3.48Å; R126-A130 VanDerWaalsContact O-N 3.13Å; L128-A130 VanDerWaalsContact C-N 3.33Å; L128-A130 PolarHBondContact O-N 3.12Å; A130-D152 HydrophobicContact CB-CB 4.22Å
131	H	89.1	Confident	88.1	Confident	30 Å²	30	61.9 Å²	61.9	14%	0.139	32%	0.319	C	S	.	.	H	α-helix	trans	-77.8	-38.1	175	167.6	79	0	0	0	112.6	C115 C118 F120 H127 L128 E129 R133 S134 H135	C115-H131 PolarHBondContact SG-NE2 3.23Å; C118-H131 VanDerWaalsContact SG-CE1 3.53Å; C118-H131 PolarHBondContact SG-NE2 3.17Å; F120-H131 HydrophobicContact CD1-CB 3.89Å; F120-H131 AromaticContact CD1-CD2 3.47Å; F120-H131 VanDerWaalsContact CD1-CD2 3.47Å; F120-H131 WeakPolarHBondContact CD1-CD2 3.05Å; F120-H131 AromaticContact CD1-CG 3.39Å; F120-H131 AromaticContact CD1-ND1 3.75Å; F120-H131 AromaticContact CD1-NE2 3.87Å; F120-H131 HydrophobicContact CE1-CB 3.63Å; F120-H131 AromaticContact CE1-CG 3.68Å; F120-H131 AromaticContact CG-CD2 3.98Å; F120-H131 AromaticContact CG-CE1 3.74Å; F120-H131 AromaticContact CG-CG 3.89Å; F120-H131 AromaticContact CG-ND1 3.74Å; F120-H131 AromaticContact CG-NE2 3.89Å; F120-H131 HydrophobicContact CZ-CB 4.26Å; H127-H131 VanDerWaalsContact O-CB 3.25Å; H127-H131 WeakPolarHBondContact O-CB 3.34Å; H127-H131 PolarHBondContact O-N 3.19Å; H127-H131 VanDerWaalsContact O-N 3.11Å; L128-H131 CarbonylContact O-C 3.58Å; L128-H131 WeakPolarHBondContact O-CA 3.44Å; L128-H131 WeakPolarHBondContact O-CB 3.28Å; L128-H131 PolarHBondContact O-N 2.98Å; E129-H131 VanDerWaalsContact C-N 3.35Å; H131-R133 PolarHBondContact O-N 2.97Å; H131-R133 VanDerWaalsContact O-N 3.12Å; H131-S134 PolarHBondContact O-N 3.01Å; H131-S134 PolarHBondContact O-OG 3.15Å; H131-H135 AromaticContact CD2-NE2 3.18Å; H131-H135 PolarHBondContact CD2-NE2 3.29Å; H131-H135 AromaticContact CE1-NE2 2.79Å; H131-H135 PolarHBondContact CE1-NE2 3.19Å; H131-H135 AromaticContact ND1-NE2 3.89Å; H131-H135 AromaticContact NE2-CD2 3.7Å; H131-H135 AromaticContact NE2-NE2 2.13Å; H131-H135 PolarHBondContact NE2-NE2 3.14Å
132	M	90.6	Very high	88.1	Confident	55 Å²	55	66.5 Å²	66.5	27%	0.271	34%	0.335	S	S	.	.	H	α-helix	trans	-56.9	-32.6	177	-68.3	-53.8	-66.1	0	0	112	L117 L128 S134 H135 T136	L117-M132 HydrophobicContact CD1-CE 3.8Å; L117-M132 HydrophobicContact CG-CE 4.24Å; L128-M132 HydrophobicContact CD1-CG 4.37Å; L128-M132 HydrophobicContact CD1-SD 4.24Å; L128-M132 HydrophobicContact CG-CG 4.46Å; L128-M132 WeakPolarHBondContact O-CG 3.4Å; L128-M132 PolarHBondContact O-N 3.38Å; M132-S134 PolarHBondContact O-N 2.98Å; M132-H135 WeakPolarHBondContact O-CB 3.36Å; M132-H135 PolarHBondContact O-N 3.38Å; M132-T136 PolarHBondContact O-N 3.45Å
133	R	89.7	Confident	88.1	Confident	46 Å²	46	66.5 Å²	66.5	17%	0.174	33%	0.334	C	S	.	.	H	α-helix	trans	-65.5	-14.1	173.2	-66.7	-177.9	179.2	98.7	-5.5	115.4	E129 H131 G137 E138 S151	E129-R133 PolarHBondContact O-NH1 3.02Å; E129-R133 VanDerWaalsContact O-NH1 3.07Å; E129-R133 IonicContact OE1-CZ 2.7Å; E129-R133 IonicContact OE1-NH1 3.15Å; E129-R133 PolarHBondContact OE1-NH1 2.94Å; E129-R133 IonicContact OE1-NH2 3.9Å; E129-R133 PolarHBondContact OE1-NH2 2.82Å; H131-R133 PolarHBondContact O-N 2.97Å; H131-R133 VanDerWaalsContact O-N 3.12Å; R133-G137 CarbonylContact O-C 3.54Å; R133-G137 WeakPolarHBondContact O-CA 3.44Å; R133-G137 PolarHBondContact O-N 3.21Å; R133-G137 VanDerWaalsContact O-N 3.1Å; R133-E138 HydrophobicContact CB-CB 4.15Å; R133-E138 HydrophobicContact CG-CB 4.06Å; R133-E138 IonicContact NE-OE2 3.9Å; R133-E138 PolarHBondContact O-N 3.44Å; R133-E138 VanDerWaalsContact O-N 3.16Å; R133-S151 WeakPolarHBondContact CD-O 3.5Å
134	S	85.9	Confident	88.1	Confident	76 Å²	76	71.2 Å²	71.2	53%	0.531	36%	0.358	S	S	.	.	H	α-helix	trans	-78	-23.2	167.6	62.9	0	0	0	0	113	H131 M132	H131-S134 PolarHBondContact O-N 3.01Å; H131-S134 PolarHBondContact O-OG 3.15Å; M132-S134 PolarHBondContact O-N 2.98Å
135	H	86.4	Confident	88.2	Confident	89 Å²	89	73.9 Å²	73.9	41%	0.412	38%	0.375	S	S	.	.	H	α-helix	trans	-82.1	-41.6	173.6	-61.5	-70.3	0	0	0	111.7	C115 L117 C118 H131 M132 G137	C115-H135 PolarHBondContact SG-NE2 3.36Å; L117-H135 HydrophobicContact CD1-CB 3.67Å; C118-H135 WeakPolarHBondContact CB-CE1 3.41Å; C118-H135 PolarHBondContact SG-CE1 3.19Å; C118-H135 PolarHBondContact SG-NE2 3.32Å; H131-H135 AromaticContact CD2-NE2 3.18Å; H131-H135 PolarHBondContact CD2-NE2 3.29Å; H131-H135 AromaticContact CE1-NE2 2.79Å; H131-H135 PolarHBondContact CE1-NE2 3.19Å; H131-H135 AromaticContact ND1-NE2 3.89Å; H131-H135 AromaticContact NE2-CD2 3.7Å; H131-H135 AromaticContact NE2-NE2 2.13Å; H131-H135 PolarHBondContact NE2-NE2 3.14Å; M132-H135 WeakPolarHBondContact O-CB 3.36Å; M132-H135 PolarHBondContact O-N 3.38Å; H135-G137 VanDerWaalsContact C-N 3.27Å; H135-G137 PolarHBondContact O-N 3.17Å
136	T	85.8	Confident	88.2	Confident	88 Å²	88	70.6 Å²	70.6	54%	0.54	36%	0.364	S	S	.	.	S	Bend	trans	-78	-10.1	174.4	66.5	0	0	0	0	113.7	M132 E138	M132-T136 PolarHBondContact O-N 3.45Å; T136-E138 PolarHBondContact O-N 3.48Å; T136-E138 WeakPolarHBondContact OG1-CB 3.24Å; T136-E138 WeakPolarHBondContact OG1-CG 3.22Å; T136-E138 PolarHBondContact OG1-OE1 2.91Å; T136-E138 VanDerWaalsContact OG1-OE1 3.07Å
137	G	84.4	Confident	88.3	Confident	43 Å²	43	70 Å²	70	44%	0.443	39%	0.385	S	S	.	.			trans	71.7	2.5	-176.6	0	0	0	0	0	114.9	R133 H135 K139	R133-G137 CarbonylContact O-C 3.54Å; R133-G137 WeakPolarHBondContact O-CA 3.44Å; R133-G137 PolarHBondContact O-N 3.21Å; R133-G137 VanDerWaalsContact O-N 3.1Å; H135-G137 VanDerWaalsContact C-N 3.27Å; H135-G137 PolarHBondContact O-N 3.17Å; G137-K139 PolarHBondContact O-N 3.3Å
138	E	86.6	Confident	88.3	Confident	96 Å²	96	70.7 Å²	70.7	45%	0.449	39%	0.386	S	S	.	.			trans	-60.6	129.7	-175.1	-86.4	175.6	-125.2	0	0	113.9	R133 T136 P140 S151	R133-E138 HydrophobicContact CB-CB 4.15Å; R133-E138 HydrophobicContact CG-CB 4.06Å; R133-E138 IonicContact NE-OE2 3.9Å; R133-E138 PolarHBondContact O-N 3.44Å; R133-E138 VanDerWaalsContact O-N 3.16Å; T136-E138 PolarHBondContact O-N 3.48Å; T136-E138 WeakPolarHBondContact OG1-CB 3.24Å; T136-E138 WeakPolarHBondContact OG1-CG 3.22Å; T136-E138 PolarHBondContact OG1-OE1 2.91Å; T136-E138 VanDerWaalsContact OG1-OE1 3.07Å; E138-P140 VanDerWaalsContact C-CD 3.46Å; E138-P140 WeakPolarHBondContact O-CD 3.16Å; E138-S151 WeakPolarHBondContact O-CA 3.46Å; E138-S151 WeakPolarHBondContact O-CB 3.46Å
139	K	86.9	Confident	88.3	Confident	119 Å²	119	75.9 Å²	75.9	52%	0.517	41%	0.405	S	S	.	.			trans	-126.7	67	177.6	-65	166	-168	168.9	0	110.5	G137 Y141 R149 C150	G137-K139 PolarHBondContact O-N 3.3Å; K139-Y141 VanDerWaalsContact C-N 3.28Å; K139-Y141 PolarHBondContact O-N 3.17Å; K139-R149 HydrophobicContact CB-CB 3.81Å; K139-R149 VanDerWaalsContact O-CZ 3.31Å; K139-R149 PolarHBondContact O-NE 2.71Å; K139-R149 PolarHBondContact O-NH2 3.46Å; K139-C150 CarbonylContact C-O 3.55Å; K139-C150 WeakPolarHBondContact CA-O 3.48Å
140	P	86.6	Confident	88.1	Confident	59 Å²	59	71.9 Å²	71.9	38%	0.383	39%	0.387	S	S	.	.			trans	-65.2	-31.6	-176.6	26.5	-34.5	0	0	0	112.3	E138 K142	E138-P140 VanDerWaalsContact C-CD 3.46Å; E138-P140 WeakPolarHBondContact O-CD 3.16Å; P140-K142 PolarHBondContact O-N 3.42Å
141	Y	88.4	Confident	88.1	Confident	59 Å²	59	72.5 Å²	72.5	23%	0.231	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	101	-178.3	-56.6	-68.8	0	0	0	111.1	K139 R149 C150 S151 R153	K139-Y141 VanDerWaalsContact C-N 3.28Å; K139-Y141 PolarHBondContact O-N 3.17Å; Y141-R149 CarbonylContact O-C 3.59Å; Y141-R149 VanDerWaalsContact O-CA 3.26Å; Y141-R149 WeakPolarHBondContact O-CA 3.44Å; Y141-C150 WeakPolarHBondContact CB-O 3.48Å; Y141-C150 PolarHBondContact N-O 3.01Å; Y141-C150 PolarHBondContact O-N 3.31Å; Y141-S151 WeakPolarHBondContact CD2-O 3.43Å; Y141-S151 VanDerWaalsContact CE2-O 3.29Å; Y141-S151 WeakPolarHBondContact CE2-O 3.48Å; Y141-R153 HydrophobicContact CD1-CB 4.17Å; Y141-R153 HydrophobicContact CD1-CG 4.28Å; Y141-R153 HydrophobicContact CD2-CB 4.45Å; Y141-R153 HydrophobicContact CE1-CB 3.82Å; Y141-R153 HydrophobicContact CE1-CG 4Å; Y141-R153 HydrophobicContact CE2-CB 4.12Å; Y141-R153 HydrophobicContact CG-CB 4.47Å
142	K	90.7	Very high	88.1	Confident	125 Å²	125	72.4 Å²	72.4	54%	0.543	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	153.8	169.5	67.2	179.3	-176.3	178.2	0	111.8	P140 F148 R149 L156	P140-K142 PolarHBondContact O-N 3.42Å; K142-F148 CarbonylContact C-O 3.35Å; K142-R149 HydrophobicContact CB-CG 4.14Å; K142-L156 VanDerWaalsContact O-CD2 3.24Å; K142-L156 WeakPolarHBondContact O-CD2 3.34Å
143	C	90.3	Very high	87.9	Confident	9 Å²	9	78 Å²	78	6%	0.061	41%	0.409	C	S	.	.			trans	-86.6	139.5	164.2	-165.8	0	0	0	0	110.2	L145 F148 L156 H159	C143-L145 VanDerWaalsContact C-N 3.25Å; C143-L145 PolarHBondContact O-N 3.41Å; C143-F148 HydrophobicContact CB-CB 4.2Å; C143-F148 PolarHBondContact N-O 3.39Å; C143-L156 HydrophobicContact CB-CD1 3.88Å; C143-H159 PolarHBondContact SG-NE2 3.11Å
144	D	89.6	Confident	87.8	Confident	113 Å²	113	78.3 Å²	78.3	60%	0.604	42%	0.418	S	S	*	.	S	Bend	trans	-83.1	-5.8	178.5	-42.8	-68.3	0	0	0	112.4	R160	D144-R160 IonicContact OD2-NH1 2.66Å
145	L	88.1	Confident	88	Confident	106 Å²	106	78.8 Å²	78.8	56%	0.555	42%	0.415	S	S	*	.	S	Bend	trans	-118.2	-4.3	-173.5	-60.2	175.8	0	0	0	113.8	C143 H164	C143-L145 VanDerWaalsContact C-N 3.25Å; C143-L145 PolarHBondContact O-N 3.41Å; L145-H164 VanDerWaalsContact CB-CE1 3.48Å; L145-H164 WeakPolarHBondContact CB-CE1 3.46Å; L145-H164 HydrophobicContact CD1-CB 3.72Å; L145-H164 PolarHBondContact O-CE1 3.12Å
146	C	90.1	Very high	88.1	Confident	53 Å²	53	75.6 Å²	75.6	36%	0.358	40%	0.401	S	S	.	.	S	Bend	trans	-166.6	169.7	171	67	0	0	0	0	110.6	F148 H159 H164	C146-F148 PolarHBondContact O-N 3.4Å; C146-F148 VanDerWaalsContact SG-CB 3.57Å; C146-H159 PolarHBondContact SG-NE2 3.33Å; C146-H159 VanDerWaalsContact SG-NE2 3.36Å; C146-H164 PolarHBondContact SG-NE2 3.47Å
147	A	89	Confident	88.3	Confident	103 Å²	103	74 Å²	74	85%	0.851	39%	0.393	S	S	*	.	S	Bend	trans	-68.1	8.4	-179.5	0	0	0	0	0	115.9
148	F	88.6	Confident	88.5	Confident	80 Å²	80	76.5 Å²	76.5	35%	0.351	39%	0.393	S	S	.	.			trans	-66	134.8	179.7	-178.9	-97.5	0	0	0	112	K142 C143 C146 C150 H159	K142-F148 CarbonylContact C-O 3.35Å; C143-F148 HydrophobicContact CB-CB 4.2Å; C143-F148 PolarHBondContact N-O 3.39Å; C146-F148 PolarHBondContact O-N 3.4Å; C146-F148 VanDerWaalsContact SG-CB 3.57Å; F148-C150 HydrophobicContact CE1-CB 3.89Å; F148-C150 HydrophobicContact CZ-CB 4.06Å; F148-H159 VanDerWaalsContact CB-CE1 3.47Å; F148-H159 WeakPolarHBondContact CB-CE1 3.49Å; F148-H159 HydrophobicContact CD1-CB 3.96Å; F148-H159 AromaticContact CD1-CD2 3.6Å; F148-H159 AromaticContact CD1-CE1 3.79Å; F148-H159 AromaticContact CD1-CG 3.4Å; F148-H159 VanDerWaalsContact CD1-CG 3.4Å; F148-H159 AromaticContact CD1-ND1 3.52Å; F148-H159 AromaticContact CD1-NE2 3.87Å; F148-H159 AromaticContact CD2-ND1 3.82Å; F148-H159 HydrophobicContact CE1-CB 3.64Å; F148-H159 AromaticContact CE1-CG 3.62Å; F148-H159 AromaticContact CE1-ND1 3.87Å; F148-H159 AromaticContact CG-CE1 3.49Å; F148-H159 VanDerWaalsContact CG-CE1 3.49Å; F148-H159 WeakPolarHBondContact CG-CE1 3.45Å; F148-H159 AromaticContact CG-CG 3.89Å; F148-H159 AromaticContact CG-ND1 3.49Å; F148-H159 WeakPolarHBondContact CG-ND1 3.44Å; F148-H159 AromaticContact CG-NE2 3.88Å; F148-H159 HydrophobicContact CZ-CB 4.21Å
149	R	89.4	Confident	88.6	Confident	133 Å²	133	73.2 Å²	73.2	50%	0.502	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.6	174.7	-53.4	-172.8	64.7	131.3	0.6	111.6	K139 Y141 K142	K139-R149 HydrophobicContact CB-CB 3.81Å; K139-R149 VanDerWaalsContact O-CZ 3.31Å; K139-R149 PolarHBondContact O-NE 2.71Å; K139-R149 PolarHBondContact O-NH2 3.46Å; Y141-R149 CarbonylContact O-C 3.59Å; Y141-R149 VanDerWaalsContact O-CA 3.26Å; Y141-R149 WeakPolarHBondContact O-CA 3.44Å; K142-R149 HydrophobicContact CB-CG 4.14Å
150	C	86.8	Confident	88.6	Confident	11 Å²	11	69.9 Å²	69.9	7%	0.074	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	164	178.3	56.6	0	0	0	0	113.3	K139 Y141 F148 D152 N155 L156	K139-C150 CarbonylContact C-O 3.55Å; K139-C150 WeakPolarHBondContact CA-O 3.48Å; Y141-C150 WeakPolarHBondContact CB-O 3.48Å; Y141-C150 PolarHBondContact N-O 3.01Å; Y141-C150 PolarHBondContact O-N 3.31Å; F148-C150 HydrophobicContact CE1-CB 3.89Å; F148-C150 HydrophobicContact CZ-CB 4.06Å; C150-D152 PolarHBondContact SG-O 3.11Å; C150-N155 HydrophobicContact CB-CB 4.28Å; C150-L156 PolarHBondContact SG-N 3.36Å; C150-L156 VanDerWaalsContact SG-N 3.42Å
151	S	87.8	Confident	88.7	Confident	30 Å²	30	74 Å²	74	21%	0.21	37%	0.37	C	S	.	.	S	Bend	trans	-78	-23.2	179.4	48.6	0	0	0	0	114.1	R133 E138 Y141	R133-S151 WeakPolarHBondContact CD-O 3.5Å; E138-S151 WeakPolarHBondContact O-CA 3.46Å; E138-S151 WeakPolarHBondContact O-CB 3.46Å; Y141-S151 WeakPolarHBondContact CD2-O 3.43Å; Y141-S151 VanDerWaalsContact CE2-O 3.29Å; Y141-S151 WeakPolarHBondContact CE2-O 3.48Å
152	D	87.6	Confident	88.6	Confident	27 Å²	27	79.4 Å²	79.4	14%	0.144	39%	0.39	C	S	.	.			trans	-119.6	144.3	-177.9	162.7	50.6	0	0	0	113	A130 C150 S154 N155 L156	A130-D152 HydrophobicContact CB-CB 4.22Å; C150-D152 PolarHBondContact SG-O 3.11Å; D152-S154 PolarHBondContact OD1-N 3.34Å; D152-S154 PolarHBondContact OD1-OG 3.48Å; D152-S154 VanDerWaalsContact OD2-CA 3.27Å; D152-S154 WeakPolarHBondContact OD2-CA 3.44Å; D152-S154 WeakPolarHBondContact OD2-CB 3.44Å; D152-S154 PolarHBondContact OD2-N 2.95Å; D152-S154 PolarHBondContact OD2-OG 2.84Å; D152-N155 HydrophobicContact CB-CB 4.3Å; D152-N155 PolarHBondContact OD2-N 3.44Å; D152-L156 PolarHBondContact O-N 3.44Å
153	R	88	Confident	88.3	Confident	173 Å²	173	82.9 Å²	82.9	65%	0.653	40%	0.399	S	S	*	.	H	α-helix	trans	-70.8	-32	178	-165.4	-179.2	-175.4	88.9	-1.7	112.5	Y141 L156 S157	Y141-R153 HydrophobicContact CD1-CB 4.17Å; Y141-R153 HydrophobicContact CD1-CG 4.28Å; Y141-R153 HydrophobicContact CD2-CB 4.45Å; Y141-R153 HydrophobicContact CE1-CB 3.82Å; Y141-R153 HydrophobicContact CE1-CG 4Å; Y141-R153 HydrophobicContact CE2-CB 4.12Å; Y141-R153 HydrophobicContact CG-CB 4.47Å; R153-L156 PolarHBondContact O-N 3.42Å; R153-S157 PolarHBondContact O-N 2.89Å; R153-S157 VanDerWaalsContact O-N 3.07Å
154	S	87.7	Confident	87.9	Confident	53 Å²	53	84.6 Å²	84.6	37%	0.371	41%	0.406	S	S	.	.	H	α-helix	trans	-66.7	-47.1	176.8	-29.4	0	0	0	0	109.6	D152 L156 S157 H158	D152-S154 PolarHBondContact OD1-N 3.34Å; D152-S154 PolarHBondContact OD1-OG 3.48Å; D152-S154 VanDerWaalsContact OD2-CA 3.27Å; D152-S154 WeakPolarHBondContact OD2-CA 3.44Å; D152-S154 WeakPolarHBondContact OD2-CB 3.44Å; D152-S154 PolarHBondContact OD2-N 2.95Å; D152-S154 PolarHBondContact OD2-OG 2.84Å; S154-L156 VanDerWaalsContact C-N 3.32Å; S154-L156 PolarHBondContact O-N 3.14Å; S154-S157 CarbonylContact O-C 3.55Å; S154-S157 WeakPolarHBondContact O-CA 3.48Å; S154-S157 VanDerWaalsContact O-CB 3.3Å; S154-S157 WeakPolarHBondContact O-CB 3.43Å; S154-S157 PolarHBondContact O-N 2.94Å; S154-H158 PolarHBondContact O-CD2 3.21Å; S154-H158 VanDerWaalsContact O-CD2 3.26Å; S154-H158 PolarHBondContact O-N 3.1Å
155	N	88.4	Confident	87	Confident	86 Å²	86	88.7 Å²	88.7	46%	0.46	42%	0.419	S	S	.	.	H	α-helix	trans	-55.5	-41.6	173.1	-76	-26.4	0	0	0	112.6	C150 D152 S157 H158 H159	C150-N155 HydrophobicContact CB-CB 4.28Å; D152-N155 HydrophobicContact CB-CB 4.3Å; D152-N155 PolarHBondContact OD2-N 3.44Å; N155-S157 PolarHBondContact O-N 3.37Å; N155-H158 PolarHBondContact O-N 3.4Å; N155-H159 WeakPolarHBondContact O-CB 3.39Å; N155-H159 PolarHBondContact O-N 3Å
156	L	89.8	Confident	85.7	Confident	22 Å²	22	90.5 Å²	90.5	12%	0.115	43%	0.428	C	S	.	.	H	α-helix	trans	-62.2	-42.2	172.2	180	61.5	0	0	0	112.2	K142 C143 C150 D152 R153 S154 H158 H159 R160	K142-L156 VanDerWaalsContact O-CD2 3.24Å; K142-L156 WeakPolarHBondContact O-CD2 3.34Å; C143-L156 HydrophobicContact CB-CD1 3.88Å; C150-L156 PolarHBondContact SG-N 3.36Å; C150-L156 VanDerWaalsContact SG-N 3.42Å; D152-L156 PolarHBondContact O-N 3.44Å; R153-L156 PolarHBondContact O-N 3.42Å; S154-L156 VanDerWaalsContact C-N 3.32Å; S154-L156 PolarHBondContact O-N 3.14Å; L156-H158 PolarHBondContact O-N 2.87Å; L156-H159 PolarHBondContact O-N 3.36Å; L156-R160 HydrophobicContact CD1-CG 4.15Å; L156-R160 WeakPolarHBondContact O-CB 3.48Å; L156-R160 WeakPolarHBondContact O-CG 3.22Å; L156-R160 PolarHBondContact O-N 3.11Å
157	S	89.3	Confident	83.8	Confident	53 Å²	53	94.8 Å²	94.8	37%	0.371	45%	0.447	S	S	.	.	H	α-helix	trans	-63.7	-37.4	176.3	171.1	0	0	0	0	112.8	R153 S154 N155 R161	R153-S157 PolarHBondContact O-N 2.89Å; R153-S157 VanDerWaalsContact O-N 3.07Å; S154-S157 CarbonylContact O-C 3.55Å; S154-S157 WeakPolarHBondContact O-CA 3.48Å; S154-S157 VanDerWaalsContact O-CB 3.3Å; S154-S157 WeakPolarHBondContact O-CB 3.43Å; S154-S157 PolarHBondContact O-N 2.94Å; N155-S157 PolarHBondContact O-N 3.37Å; S157-R161 WeakPolarHBondContact O-CB 3.43Å; S157-R161 WeakPolarHBondContact O-CG 3.31Å; S157-R161 PolarHBondContact O-N 3.47Å; S157-R161 VanDerWaalsContact O-N 3.13Å; S157-R161 PolarHBondContact O-NE 2.82Å; S157-R161 PolarHBondContact OG-NE 2.74Å; S157-R161 PolarHBondContact OG-NH2 3.23Å
158	H	88.3	Confident	81.6	Confident	96 Å²	96	95.3 Å²	95.3	44%	0.444	44%	0.442	S	S	.	.	H	α-helix	trans	-72.4	-45.7	175	-81.6	-88.6	0	0	0	111.8	S154 N155 L156 R160 R161 R162	S154-H158 PolarHBondContact O-CD2 3.21Å; S154-H158 VanDerWaalsContact O-CD2 3.26Å; S154-H158 PolarHBondContact O-N 3.1Å; N155-H158 PolarHBondContact O-N 3.4Å; L156-H158 PolarHBondContact O-N 2.87Å; H158-R160 PolarHBondContact O-N 3.04Å; H158-R161 PolarHBondContact CD2-NH2 3.03Å; H158-R161 PolarHBondContact CE1-NH2 3.06Å; H158-R161 PolarHBondContact NE2-NH2 2.99Å; H158-R161 PolarHBondContact O-N 3.07Å; H158-R162 WeakPolarHBondContact O-CB 3.36Å; H158-R162 WeakPolarHBondContact O-CG 3.4Å; H158-R162 PolarHBondContact O-N 2.98Å
159	H	89.3	Confident	79.9	Confident	27 Å²	27	95.9 Å²	95.9	13%	0.125	45%	0.451	C	S	.	.	H	α-helix	trans	-52.8	-52.9	172.5	165.1	84.8	0	0	0	110.8	C143 C146 F148 N155 L156 R162 R163 H164	C143-H159 PolarHBondContact SG-NE2 3.11Å; C146-H159 PolarHBondContact SG-NE2 3.33Å; C146-H159 VanDerWaalsContact SG-NE2 3.36Å; F148-H159 VanDerWaalsContact CB-CE1 3.47Å; F148-H159 WeakPolarHBondContact CB-CE1 3.49Å; F148-H159 HydrophobicContact CD1-CB 3.96Å; F148-H159 AromaticContact CD1-CD2 3.6Å; F148-H159 AromaticContact CD1-CE1 3.79Å; F148-H159 AromaticContact CD1-CG 3.4Å; F148-H159 VanDerWaalsContact CD1-CG 3.4Å; F148-H159 AromaticContact CD1-ND1 3.52Å; F148-H159 AromaticContact CD1-NE2 3.87Å; F148-H159 AromaticContact CD2-ND1 3.82Å; F148-H159 HydrophobicContact CE1-CB 3.64Å; F148-H159 AromaticContact CE1-CG 3.62Å; F148-H159 AromaticContact CE1-ND1 3.87Å; F148-H159 AromaticContact CG-CE1 3.49Å; F148-H159 VanDerWaalsContact CG-CE1 3.49Å; F148-H159 WeakPolarHBondContact CG-CE1 3.45Å; F148-H159 AromaticContact CG-CG 3.89Å; F148-H159 AromaticContact CG-ND1 3.49Å; F148-H159 WeakPolarHBondContact CG-ND1 3.44Å; F148-H159 AromaticContact CG-NE2 3.88Å; F148-H159 HydrophobicContact CZ-CB 4.21Å; N155-H159 WeakPolarHBondContact O-CB 3.39Å; N155-H159 PolarHBondContact O-N 3Å; L156-H159 PolarHBondContact O-N 3.36Å; H159-R162 PolarHBondContact O-N 3.46Å; H159-R163 WeakPolarHBondContact O-CB 3.38Å; H159-R163 PolarHBondContact O-N 3.27Å; H159-H164 AromaticContact NE2-CD2 3.59Å; H159-H164 AromaticContact NE2-NE2 3.33Å; H159-H164 PolarHBondContact NE2-NE2 3.11Å
160	R	86.6	Confident	77.7	Confident	49 Å²	49	100 Å²	100	19%	0.185	47%	0.467	C	S	.	.	H	α-helix	trans	-58.9	-52.9	179.8	-75.1	179.7	56.2	-164.4	-14.3	111.6	D144 L156 H158 R162 H164 T169	D144-R160 IonicContact OD2-NH1 2.66Å; L156-R160 HydrophobicContact CD1-CG 4.15Å; L156-R160 WeakPolarHBondContact O-CB 3.48Å; L156-R160 WeakPolarHBondContact O-CG 3.22Å; L156-R160 PolarHBondContact O-N 3.11Å; H158-R160 PolarHBondContact O-N 3.04Å; R160-R162 VanDerWaalsContact C-N 3.27Å; R160-R162 PolarHBondContact O-N 3.27Å; R160-H164 CarbonylContact O-C 3.52Å; R160-H164 WeakPolarHBondContact O-CA 3.21Å; R160-H164 PolarHBondContact O-N 3.02Å; R160-T169 VanDerWaalsContact CZ-OG1 3.3Å; R160-T169 PolarHBondContact NH1-OG1 3.47Å; R160-T169 VanDerWaalsContact NH1-OG1 3.13Å; R160-T169 PolarHBondContact NH2-OG1 3.26Å
161	R	88.4	Confident	75.6	Confident	146 Å²	146	104.8 Å²	104.8	55%	0.551	50%	0.496	S	S	*	.	H	α-helix	trans	-59	-31.1	178.4	-77.9	178.3	-74.6	150.5	-3	114.5	S157 H158	S157-R161 WeakPolarHBondContact O-CB 3.43Å; S157-R161 WeakPolarHBondContact O-CG 3.31Å; S157-R161 PolarHBondContact O-N 3.47Å; S157-R161 VanDerWaalsContact O-N 3.13Å; S157-R161 PolarHBondContact O-NE 2.82Å; S157-R161 PolarHBondContact OG-NE 2.74Å; S157-R161 PolarHBondContact OG-NH2 3.23Å; H158-R161 PolarHBondContact CD2-NH2 3.03Å; H158-R161 PolarHBondContact CE1-NH2 3.06Å; H158-R161 PolarHBondContact NE2-NH2 2.99Å; H158-R161 PolarHBondContact O-N 3.07Å
162	R	86.8	Confident	73.2	Confident	173 Å²	173	107.9 Å²	107.9	65%	0.653	52%	0.523	S	S	*	.	H	α-helix	trans	-90.5	-37.3	-178.1	-69.3	-68.2	-155.6	-176.9	9.6	113.8	H158 H159 R160	H158-R162 WeakPolarHBondContact O-CB 3.36Å; H158-R162 WeakPolarHBondContact O-CG 3.4Å; H158-R162 PolarHBondContact O-N 2.98Å; H159-R162 PolarHBondContact O-N 3.46Å; R160-R162 VanDerWaalsContact C-N 3.27Å; R160-R162 PolarHBondContact O-N 3.27Å
163	R	84.2	Confident	70.9	Confident	197 Å²	197	115.6 Å²	115.6	74%	0.743	55%	0.55	S	S	*	*	H	α-helix	trans	-98.7	-32	-174.3	-61.8	-61.4	-173.5	171.5	0.9	113.5	H159	H159-R163 WeakPolarHBondContact O-CB 3.38Å; H159-R163 PolarHBondContact O-N 3.27Å
164	H	83.4	Confident	69	Low	46 Å²	46	111 Å²	111	21%	0.213	55%	0.545	C	S	.	.	S	Bend	trans	-115.3	88.2	179.9	-57.1	-75.9	0	0	0	108.7	L145 C146 H159 R160 L166	L145-H164 VanDerWaalsContact CB-CE1 3.48Å; L145-H164 WeakPolarHBondContact CB-CE1 3.46Å; L145-H164 HydrophobicContact CD1-CB 3.72Å; L145-H164 PolarHBondContact O-CE1 3.12Å; C146-H164 PolarHBondContact SG-NE2 3.47Å; H159-H164 AromaticContact NE2-CD2 3.59Å; H159-H164 AromaticContact NE2-NE2 3.33Å; H159-H164 PolarHBondContact NE2-NE2 3.11Å; R160-H164 CarbonylContact O-C 3.52Å; R160-H164 WeakPolarHBondContact O-CA 3.21Å; R160-H164 PolarHBondContact O-N 3.02Å; H164-L166 PolarHBondContact O-N 3.42Å
165	K	70.2	Confident	67.1	Low	199 Å²	199	113.7 Å²	113.7	87%	0.865	56%	0.561	S	S	*	*			trans	-62.5	13.2	-169.3	-73.3	-173.5	175.3	-179.4	0	116.4
166	L	59.6	Low	65.3	Low	144 Å²	144	117 Å²	117	75%	0.754	57%	0.571	S	S	*	*	S	Bend	trans	-125.9	128.7	-179.4	-80.7	178.3	0	0	0	114.4	H164	H164-L166 PolarHBondContact O-N 3.42Å
167	L	49.8	Very low	63.6	Low	143 Å²	143	118.7 Å²	118.7	75%	0.749	59%	0.585	S	S	*	*			trans	62	131.8	161.7	-54.1	-177.1	0	0	0	118.1
168	P	44.8	Very low	61.5	Low	114 Å²	114	120.5 Å²	120.5	74%	0.74	59%	0.591	S	S	*	*			trans	-54.5	155.2	161.9	-21.9	32.8	0	0	0	110.7	R170	P168-R170 PolarHBondContact O-N 3.19Å
169	T	51.2	Low	60	Low	91 Å²	91	124.4 Å²	124.4	56%	0.558	61%	0.606	S	S	*	*			trans	-70	68.5	165.8	-29.1	0	0	0	0	110.2	R160 V171	R160-T169 VanDerWaalsContact CZ-OG1 3.3Å; R160-T169 PolarHBondContact NH1-OG1 3.47Å; R160-T169 VanDerWaalsContact NH1-OG1 3.13Å; R160-T169 PolarHBondContact NH2-OG1 3.26Å; T169-V171 HydrophobicContact CG2-CG2 4.17Å; T169-V171 PolarHBondContact O-N 2.9Å
170	R	43.6	Very low	58.2	Low	219 Å²	219	133.6 Å²	133.6	83%	0.826	64%	0.64	S	S	*	*			trans	-66.8	78.7	151.2	-171.5	-174.3	-67.4	-160.5	3.5	105.6	P168 A172	P168-R170 PolarHBondContact O-N 3.19Å; R170-A172 PolarHBondContact O-N 3.22Å
171	V	43	Very low	56.4	Low	112 Å²	112	134.4 Å²	134.4	68%	0.679	65%	0.651	S	S	*	*			trans	-36.5	125.4	149.1	175.5	0	0	0	0	105.3	T169 R173	T169-V171 HydrophobicContact CG2-CG2 4.17Å; T169-V171 PolarHBondContact O-N 2.9Å; V171-R173 PolarHBondContact O-N 3.16Å
172	A	36.9	Very low	54.8	Low	95 Å²	95	131.4 Å²	131.4	79%	0.785	65%	0.645	S	S	*	*			trans	-61.1	90.2	-170.8	0	0	0	0	0	109.2	R170 S174	R170-A172 PolarHBondContact O-N 3.22Å; A172-S174 PolarHBondContact O-N 3.03Å; A172-S174 VanDerWaalsContact O-N 3.15Å
173	R	40.1	Very low	53.1	Low	190 Å²	190	126.2 Å²	126.2	72%	0.717	64%	0.635	S	S	*	*			trans	-56.9	124.2	168.2	-69.3	-170.1	-179.8	-169.7	-0.3	104.5	V171	V171-R173 PolarHBondContact O-N 3.16Å
174	S	48.1	Very low	51.4	Low	76 Å²	76	120.3 Å²	120.3	53%	0.531	62%	0.624	S	S	.	*			trans	-52.1	154.9	177.1	62.2	0	0	0	0	109.4	A172 F176 S177	A172-S174 PolarHBondContact O-N 3.03Å; A172-S174 VanDerWaalsContact O-N 3.15Å; S174-F176 PolarHBondContact O-N 3.38Å; S174-S177 PolarHBondContact O-N 3.41Å
175	P	48	Very low	49.9	Very low	109 Å²	109	123.1 Å²	123.1	71%	0.708	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	-11	-173.9	-29.5	36.9	0	0	0	115.8
176	F	50.2	Low	49	Very low	155 Å²	155	120.6 Å²	120.6	68%	0.68	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	13.4	-171.3	-54.7	-74.8	0	0	0	115.4	S174 N178	S174-F176 PolarHBondContact O-N 3.38Å; F176-N178 VanDerWaalsContact C-N 3.33Å; F176-N178 PolarHBondContact O-N 3.22Å
177	S	53.1	Low	48.6	Very low	58 Å²	58	122.3 Å²	122.3	41%	0.406	63%	0.633	S	S	.	*			trans	-79.6	-8	176.2	85.6	0	0	0	0	115.3	S174	S174-S177 PolarHBondContact O-N 3.41Å
178	N	46	Very low	48.5	Very low	92 Å²	92	125.3 Å²	125.3	49%	0.492	63%	0.634	S	S	.	*			trans	-98.9	91.4	-174.7	-76.8	-11	0	0	0	111.6	F176 R180 T181 L182	F176-N178 VanDerWaalsContact C-N 3.33Å; F176-N178 PolarHBondContact O-N 3.22Å; N178-R180 PolarHBondContact O-N 3.33Å; N178-T181 HydrophobicContact CB-CG2 4.23Å; N178-T181 WeakPolarHBondContact CB-OG1 3.42Å; N178-T181 PolarHBondContact O-N 3.39Å; N178-T181 PolarHBondContact O-OG1 3.29Å; N178-L182 PolarHBondContact O-N 3.22Å
179	K	57.5	Low	48.6	Very low	178 Å²	178	125 Å²	125	77%	0.774	63%	0.631	S	S	*	*	H	α-helix	trans	-49	-34.9	173.1	-67.8	-170.2	175.7	-171.7	0	112.8	T181 L182 S183	K179-T181 PolarHBondContact O-N 3.15Å; K179-L182 PolarHBondContact O-N 3.11Å; K179-S183 PolarHBondContact O-N 3.45Å; K179-S183 VanDerWaalsContact O-N 3.14Å; K179-S183 PolarHBondContact O-OG 3.33Å
180	R	50	Low	48.3	Very low	219 Å²	219	123.6 Å²	123.6	83%	0.826	63%	0.634	S	S	*	*	H	α-helix	trans	-66.6	-29.1	179.8	-155.5	-179.7	-67.9	178.1	-1.6	114	N178 S184	N178-R180 PolarHBondContact O-N 3.33Å; R180-S184 PolarHBondContact O-OG 2.85Å
181	T	50.6	Low	48.9	Very low	67 Å²	67	118.1 Å²	118.1	41%	0.411	63%	0.629	S	S	.	*	H	α-helix	trans	-83.6	-31.9	175.2	52.1	0	0	0	0	112.3	N178 K179 S184 L185	N178-T181 HydrophobicContact CB-CG2 4.23Å; N178-T181 WeakPolarHBondContact CB-OG1 3.42Å; N178-T181 PolarHBondContact O-N 3.39Å; N178-T181 PolarHBondContact O-OG1 3.29Å; K179-T181 PolarHBondContact O-N 3.15Å; T181-S184 PolarHBondContact O-N 3.33Å; T181-L185 PolarHBondContact O-N 3.24Å
182	L	52.9	Low	49.1	Very low	82 Å²	82	120.4 Å²	120.4	43%	0.429	64%	0.637	S	S	.	*	H	α-helix	trans	-59.4	-45.6	170.2	-68.6	173.4	0	0	0	111	N178 K179 S184 L185 Q186	N178-L182 PolarHBondContact O-N 3.22Å; K179-L182 PolarHBondContact O-N 3.11Å; L182-S184 VanDerWaalsContact C-N 3.27Å; L182-S184 PolarHBondContact O-N 2.91Å; L182-L185 PolarHBondContact O-N 3.07Å; L182-Q186 WeakPolarHBondContact O-CB 3.5Å; L182-Q186 PolarHBondContact O-N 2.79Å
183	S	52.7	Low	49.1	Very low	65 Å²	65	118.9 Å²	118.9	46%	0.455	63%	0.63	S	S	.	*	H	α-helix	trans	-59.3	-34.5	174.7	-53.8	0	0	0	0	113.5	K179 K187	K179-S183 PolarHBondContact O-N 3.45Å; K179-S183 VanDerWaalsContact O-N 3.14Å; K179-S183 PolarHBondContact O-OG 3.33Å; S183-K187 WeakPolarHBondContact O-CB 3.42Å; S183-K187 VanDerWaalsContact O-CG 3.28Å; S183-K187 WeakPolarHBondContact O-CG 3.38Å; S183-K187 PolarHBondContact O-N 3.3Å; S183-K187 VanDerWaalsContact O-N 3.12Å
184	S	48.7	Very low	48.9	Very low	72 Å²	72	120 Å²	120	50%	0.503	64%	0.64	S	S	.	*	H	α-helix	trans	-77.3	-28.8	177.7	-60.7	0	0	0	0	113.6	R180 T181 L182 R188	R180-S184 PolarHBondContact O-OG 2.85Å; T181-S184 PolarHBondContact O-N 3.33Å; L182-S184 VanDerWaalsContact C-N 3.27Å; L182-S184 PolarHBondContact O-N 2.91Å; S184-R188 PolarHBondContact O-N 2.82Å
185	L	50.2	Low	48.6	Very low	105 Å²	105	119.9 Å²	119.9	55%	0.55	65%	0.651	S	S	.	*	H	α-helix	trans	-74.5	-46.7	171.4	-85.5	160.3	0	0	0	111.1	T181 L182 K187 R188 T189	T181-L185 PolarHBondContact O-N 3.24Å; L182-L185 PolarHBondContact O-N 3.07Å; L185-K187 VanDerWaalsContact C-N 3.27Å; L185-K187 PolarHBondContact O-N 3.49Å; L185-R188 CarbonylContact O-C 3.41Å; L185-R188 WeakPolarHBondContact O-CA 3.39Å; L185-R188 WeakPolarHBondContact O-CB 3.38Å; L185-R188 PolarHBondContact O-N 3.41Å; L185-T189 PolarHBondContact O-N 3.12Å; L185-T189 PolarHBondContact O-OG1 3.42Å
186	Q	52.6	Low	48.2	Very low	146 Å²	146	126.2 Å²	126.2	68%	0.682	66%	0.661	S	S	*	*	H	α-helix	trans	-65.5	-28.2	-179.7	-166.6	170.8	4.8	0	0	112.9	L182 R188 T189	L182-Q186 WeakPolarHBondContact O-CB 3.5Å; L182-Q186 PolarHBondContact O-N 2.79Å; Q186-R188 VanDerWaalsContact C-N 3.35Å; Q186-T189 WeakPolarHBondContact CA-OG1 3.33Å; Q186-T189 PolarHBondContact O-OG1 3.23Å; Q186-T189 VanDerWaalsContact O-OG1 3.1Å
187	K	51.4	Low	47.9	Very low	180 Å²	180	130.4 Å²	130.4	78%	0.783	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-13.9	168.9	-74.3	-177.8	176.7	-168.2	0	114.2	S183 L185	S183-K187 WeakPolarHBondContact O-CB 3.42Å; S183-K187 VanDerWaalsContact O-CG 3.28Å; S183-K187 WeakPolarHBondContact O-CG 3.38Å; S183-K187 PolarHBondContact O-N 3.3Å; S183-K187 VanDerWaalsContact O-N 3.12Å; L185-K187 VanDerWaalsContact C-N 3.27Å; L185-K187 PolarHBondContact O-N 3.49Å
188	R	46.6	Very low	47	Very low	206 Å²	206	135 Å²	135	78%	0.777	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-26	174.2	-158.5	-177.8	-60.7	178	-0.7	112.1	S184 L185 Q186 G190	S184-R188 PolarHBondContact O-N 2.82Å; L185-R188 CarbonylContact O-C 3.41Å; L185-R188 WeakPolarHBondContact O-CA 3.39Å; L185-R188 WeakPolarHBondContact O-CB 3.38Å; L185-R188 PolarHBondContact O-N 3.41Å; Q186-R188 VanDerWaalsContact C-N 3.35Å; R188-G190 PolarHBondContact O-N 2.88Å; R188-G190 VanDerWaalsContact O-N 3.13Å
189	T	47.4	Very low	46.8	Very low	109 Å²	109	138.9 Å²	138.9	67%	0.669	71%	0.711	S	S	*	*	S	Bend	trans	-80.1	38.2	162	59.3	0	0	0	0	111.7	L185 Q186 S191	L185-T189 PolarHBondContact O-N 3.12Å; L185-T189 PolarHBondContact O-OG1 3.42Å; Q186-T189 WeakPolarHBondContact CA-OG1 3.33Å; Q186-T189 PolarHBondContact O-OG1 3.23Å; Q186-T189 VanDerWaalsContact O-OG1 3.1Å; T189-S191 PolarHBondContact O-N 3.25Å
190	G	45.1	Very low	45.6	Very low	61 Å²	61	137.1 Å²	137.1	63%	0.629	71%	0.709	S	S	*	*			trans	-96.2	71.7	-178.9	0	0	0	0	0	112.1	R188	R188-G190 PolarHBondContact O-N 2.88Å; R188-G190 VanDerWaalsContact O-N 3.13Å
191	S	55.8	Low	44.8	Very low	103 Å²	103	134.2 Å²	134.2	72%	0.72	71%	0.71	S	S	*	*			trans	-172.9	169.1	156.5	-160.8	0	0	0	0	111.6	T189	T189-S191 PolarHBondContact O-N 3.25Å
192	L	46.3	Very low	43.9	Very low	161 Å²	161	138.4 Å²	138.4	84%	0.843	73%	0.729	S	S	*	*			trans	63.4	98.9	166.1	-50.4	-176	0	0	0	117
193	G	38	Very low	43.1	Very low	62 Å²	62	139.7 Å²	139.7	64%	0.639	75%	0.745	S	S	*	*			trans	-72.7	-177.5	150.6	0	0	0	0	0	112
194	F	36.3	Very low	42.4	Very low	214 Å²	214	142.1 Å²	142.1	94%	0.939	76%	0.759	S	S	*	*			trans	64.9	67.2	174.4	-58	-77.3	0	0	0	116.9
195	G	40.5	Very low	41.8	Very low	74 Å²	74	144.4 Å²	144.4	76%	0.763	77%	0.772	S	S	*	*				58.3	113.6	117.3	0	0	0	0	0	120.2
196	R	39.3	Very low	40.9	Very low	242 Å²	242	144.3 Å²	144.3	91%	0.913	78%	0.78	S	S	*	*			trans	-149.2	132.3	142.9	-102.3	155.7	-161.9	-137.8	1.3	109.5
197	R	44.5	Very low	40	Very low	243 Å²	243	143.7 Å²	143.7	92%	0.917	79%	0.786	S	S	*	*			trans	-70	127.7	161.8	-88	-177.6	171.3	176.9	-2.5	107.7
198	L	33.6	Very low	39.2	Very low	155 Å²	155	141.2 Å²	141.2	81%	0.812	79%	0.786	S	S	*	*			trans	-131.1	111.8	158.1	-75.9	175.7	0	0	0	108.3
199	L	42.3	Very low	38.7	Very low	172 Å²	172	137 Å²	137	90%	0.901	78%	0.783	S	S	*	*			trans	-86.3	116	167.3	-76.2	165.1	0	0	0	107.7
200	I	33.3	Very low	37.9	Very low	141 Å²	141	137.3 Å²	137.3	72%	0.723	79%	0.786	S	S	*	*			trans	-136.5	117.5	159.5	-53	-177.7	0	0	0	107.6	L202	I200-L202 HydrophobicContact CG2-CD1 3.75Å
201	N	33	Very low	37.1	Very low	158 Å²	158	146.3 Å²	146.3	85%	0.845	80%	0.802	S	S	*	*			trans	-85.5	132.9	170.1	-96.7	-35.3	0	0	0	109.6
202	L	31.3	Very low	35.8	Very low	155 Å²	155	145.9 Å²	145.9	81%	0.812	80%	0.798	S	S	*	*			trans	-141.4	106.4	151.6	-77.7	103.6	0	0	0	110	I200	I200-L202 HydrophobicContact CG2-CD1 3.75Å
203	S	35.2	Very low	35.2	Very low	109 Å²	109	145.3 Å²	145.3	76%	0.762	80%	0.796	S	S	*	*			trans	-79.7	146.4	146.7	-46.3	0	0	0	0	107.2
204	P	38.6	Very low	34.8	Very low	117 Å²	117	153 Å²	153	76%	0.76	81%	0.808	S	S	*	*				-154.4	-161.3	75.7	42.9	-23.2	0	0	0	112.9
205	P	37.4	Very low	34.4	Very low	119 Å²	119	153 Å²	153	77%	0.773	81%	0.807	S	S	*	*			cis	-116.1	172.2	-33.4	16.7	5	0	0	0	111.8
206	S	31.3	Very low	33.7	Very low	104 Å²	104	154.7 Å²	154.7	73%	0.727	81%	0.807	S	S	*	*			trans	-77.8	131.3	171	53.9	0	0	0	0	112.8
207	V	33.6	Very low	33.1	Very low	133 Å²	133	151.1 Å²	151.1	81%	0.806	80%	0.801	S	S	*	*			trans	-105.1	115.4	152.4	179.2	0	0	0	0	107.3	V209	V207-V209 HydrophobicContact CG1-CG2 4.39Å
208	V	34.6	Very low	32.2	Very low	127 Å²	127	149 Å²	149	77%	0.77	80%	0.799	S	S	*	*			trans	-83.8	125.9	176.8	178.3	0	0	0	0	109
209	V	34.5	Very low	31.9	Very low	119 Å²	119	146.2 Å²	146.2	72%	0.721	79%	0.792	S	S	*	*			trans	-127.3	135.3	164.6	-177.6	0	0	0	0	106.8	V207	V207-V209 HydrophobicContact CG1-CG2 4.39Å
210	P	31.4	Very low	31.3	Very low	114 Å²	114	146.8 Å²	146.8	74%	0.74	79%	0.79	S	S	*	*			trans	-64.5	142.9	-166.4	-24.5	35.2	0	0	0	114.4
211	R	28.6	Very low	31.2	Very low	251 Å²	251	147.8 Å²	147.8	95%	0.947	79%	0.789	S	S	*	*			trans	-83.9	123.9	154.1	-95.4	-177.2	157.3	96.3	-6.5	108
212	S	29.2	Very low	30.9	Very low	93 Å²	93	148.4 Å²	148.4	65%	0.65	79%	0.791	S	S	*	*			trans	-134.7	107.1	161	58.2	0	0	0	0	108.9
213	D	32.5	Very low	30.8	Very low	149 Å²	149	148.2 Å²	148.2	80%	0.797	79%	0.785	S	S	*	*			trans	59.1	79	135.2	-40.2	-41.1	0	0	0	118.1
214	Y	30.2	Very low	30.3	Very low	225 Å²	225	146.4 Å²	146.4	88%	0.882	79%	0.785	S	S	*	*			trans	-160.8	99.3	142.2	-115.1	-73.2	0	0	0	109.6
215	F	27.6	Very low	29.6	Very low	212 Å²	212	145.9 Å²	145.9	93%	0.93	78%	0.783	S	S	*	*			trans	173.5	70.4	143	-94.8	-58.7	0	0	0	113.4
216	S	26.1	Very low	28.9	Very low	110 Å²	110	147 Å²	147	77%	0.769	78%	0.779	S	S	*	*			trans	-168.7	134.4	160.8	49	0	0	0	0	105.6
217	E	26.5	Very low	28.7	Very low	167 Å²	167	151 Å²	151	78%	0.78	78%	0.779	S	S	*	*			cis	-103	176.2	3.2	-77.7	138.9	118.3	0	0	111.6
218	F	24.8	Very low	28.4	Very low	198 Å²	198	153.1 Å²	153.1	87%	0.868	78%	0.777	S	S	*	*			cis	-132.8	138.3	26	-71.3	-101.3	0	0	0	114.2
219	S	27.8	Very low	28	Very low	97 Å²	97	153.2 Å²	153.2	68%	0.678	78%	0.778	S	S	*	*			trans	-162	134.2	144.4	-79.7	0	0	0	0	109.2
220	H	30.6	Very low	28.3	Very low	185 Å²	185	153.2 Å²	153.2	86%	0.856	78%	0.781	S	S	*	*			trans	68.7	140.9	-175.6	-38.5	-71.1	0	0	0	113.8
221	K	29.6	Very low	28.5	Very low	161 Å²	161	153.6 Å²	153.6	70%	0.7	78%	0.783	S	S	*	*			cis	-138.9	147.3	25.1	-66.9	168.8	179.6	170.6	0	113.3	H223	K221-H223 WeakPolarHBondContact CD-NE2 3.23Å
222	I	26.6	Very low	28.4	Very low	172 Å²	172	150.4 Å²	150.4	88%	0.882	78%	0.776	S	S	*	*			trans	-82.2	124.5	136.1	-71.6	176	0	0	0	106.2
223	H	29.5	Very low	28.2	Very low	150 Å²	150	153.1 Å²	153.1	69%	0.694	78%	0.78	S	S	*	*			trans	-77.6	157.8	167.5	-89.4	-125.8	0	0	0	109.7	K221	K221-H223 WeakPolarHBondContact CD-NE2 3.23Å
224	G	25.5	Very low	27.9	Very low	72 Å²	72	152 Å²	152	74%	0.742	78%	0.775	S	S	*	*			cis	146.9	142.3	-0.3	0	0	0	0	0	111.1
225	S	22.8	Very low	27.9	Very low	105 Å²	105	149.5 Å²	149.5	73%	0.734	77%	0.771	S	S	*	*			trans	-151.5	142.6	177.2	-149.1	0	0	0	0	107.4
226	E	24.4	Very low	27.8	Very low	144 Å²	144	145.6 Å²	145.6	67%	0.673	76%	0.76	S	S	*	*			cis	-156.6	160.4	7.6	-146.6	168.4	-140.7	0	0	111.8
227	Y	25.9	Very low	27.9	Very low	186 Å²	186	147.7 Å²	147.7	73%	0.729	76%	0.757	S	S	*	*			trans	50.3	146.8	158.1	61	-118.2	0	0	0	126
228	K	27.3	Very low	28.1	Very low	178 Å²	178	143.7 Å²	143.7	77%	0.774	75%	0.748	S	S	*	*			trans	77.5	93.1	146.6	-78.4	166.4	-179.8	173.6	0	123.4
229	T	27.5	Very low	28.3	Very low	130 Å²	130	145.8 Å²	145.8	80%	0.798	75%	0.75	S	S	*	*				49.6	135.4	119.2	49.1	0	0	0	0	123.6
230	P	39.9	Very low	28.3	Very low	119 Å²	119	145 Å²	145	77%	0.773	76%	0.757	S	S	*	*			trans	-101.7	169.3	178.1	41.5	-36.8	0	0	0	115.5
231	P	36.7	Very low	28.1	Very low	122 Å²	122	147.4 Å²	147.4	79%	0.792	76%	0.758	S	S	*	*				-122.6	159.7	122.8	4.7	16.9	0	0	0	110.9
232	K	24.8	Very low	28	Very low	183 Å²	183	142.9 Å²	142.9	80%	0.796	76%	0.757	S	S	*	*			cis	119.7	123.3	13.2	-118.9	-164.8	179.2	-169.1	0	110.3
233	M	26.5	Very low	28	Very low	150 Å²	150	142.8 Å²	142.8	74%	0.739	75%	0.753	S	S	*	*			trans	68.1	156.7	159.4	-32.8	-91.4	-74.8	0	0	114.9
234	D	25.7	Very low	28.1	Very low	127 Å²	127	143.6 Å²	143.6	68%	0.679	76%	0.762	S	S	*	*			cis	-139.6	166.5	18.4	-87.9	-65.4	0	0	0	114.5
235	E	29.9	Very low	28.1	Very low	171 Å²	171	143.4 Å²	143.4	80%	0.799	76%	0.76	S	S	*	*			trans	-6.3	165	143.3	-61.2	-153.6	126.2	0	0	120.6
236	N	25.8	Very low	28.4	Very low	131 Å²	131	148.7 Å²	148.7	70%	0.701	77%	0.771	S	S	*	*			cis	176.4	-178.2	-16.6	-178.7	14.7	0	0	0	105.2
237	E	28.2	Very low	28.6	Very low	153 Å²	153	152.7 Å²	152.7	72%	0.715	78%	0.78	S	S	*	*			trans	66.1	159.8	166.7	-73.6	-124.6	95	0	0	117.3
238	S	30	Very low	28.7	Very low	83 Å²	83	149.4 Å²	149.4	58%	0.58	78%	0.779	S	S	*	*			cis	-169.9	168	-34.6	-103	0	0	0	0	110.5
239	R	30.2	Very low	28.6	Very low	243 Å²	243	146 Å²	146	92%	0.917	78%	0.778	S	S	*	*			trans	87	129.5	165.1	-56.5	176.4	175.4	161	1	117.6
240	G	26.5	Very low	28.7	Very low	79 Å²	79	147.1 Å²	147.1	81%	0.814	78%	0.778	S	S	*	*			trans	-124.2	177.1	159.4	0	0	0	0	0	111.8
241	R	27.9	Very low	28.1	Very low	237 Å²	237	148.2 Å²	148.2	89%	0.894	78%	0.777	S	S	*	*			trans	-159.9	126.6	165.7	-166	174.7	-72.6	-108.1	4.5	103.3
242	G	26.5	Very low	28	Very low	65 Å²	65	151 Å²	151	67%	0.67	78%	0.779	S	S	*	*				84.4	131.9	61.3	0	0	0	0	0	108.7
243	E	27.1	Very low	28.3	Very low	170 Å²	170	149.5 Å²	149.5	79%	0.794	78%	0.78	S	S	*	*			cis	-153.4	-160.8	4.7	-84.7	177.4	96.9	0	0	109
244	N	30.9	Very low	28.6	Very low	167 Å²	167	148.5 Å²	148.5	89%	0.893	79%	0.787	S	S	*	*			trans	78.9	119.3	174.8	-45.9	-34.1	0	0	0	115.7
245	G	25.8	Very low	28.8	Very low	68 Å²	68	146.9 Å²	146.9	70%	0.701	79%	0.791	S	S	*	*			cis	129.3	89.9	-11.5	0	0	0	0	0	114.3
246	F	29.3	Very low	28.8	Very low	217 Å²	217	146.8 Å²	146.8	95%	0.952	80%	0.796	S	S	*	*			trans	-135.4	121.5	159.4	-91.7	-78.2	0	0	0	111.1
247	R	28.2	Very low	28.9	Very low	228 Å²	228	145.4 Å²	145.4	86%	0.86	80%	0.802	S	S	*	*			trans	-88.9	162.9	164.9	-80.7	-176.2	165.1	-164.8	-3.7	108.1
248	T	27.3	Very low	29	Very low	116 Å²	116	141.1 Å²	141.1	71%	0.712	80%	0.799	S	S	*	*			cis	-163.6	179.4	6.9	2.6	0	0	0	0	109.7
249	S	26.3	Very low	29.1	Very low	107 Å²	107	146.1 Å²	146.1	75%	0.748	81%	0.813	S	S	*	*			trans	86.4	138.7	153.3	-55.1	0	0	0	0	118.3
250	L	28.6	Very low	29	Very low	153 Å²	153	142 Å²	142	80%	0.801	81%	0.808	S	S	*	*			cis	-158.9	154.3	-21.5	-172.8	59.6	0	0	0	109.6
251	D	29	Very low	29.1	Very low	142 Å²	142	142.7 Å²	142.7	76%	0.759	81%	0.806	S	S	*	*			trans	-66	132.9	-178.9	-47.2	-97.9	0	0	0	115.2
252	Q	34.4	Very low	29.3	Very low	180 Å²	180	137 Å²	137	84%	0.841	80%	0.803	S	S	*	*			trans	-158	124.2	154.5	-76	-154.1	9.1	0	0	107.4
253	L	30.5	Very low	29.7	Very low	153 Å²	153	139.9 Å²	139.9	80%	0.801	81%	0.81	S	S	*	*			cis	-142.7	156.6	3.9	-70.5	166.2	0	0	0	111.3
254	S	31.7	Very low	29.9	Very low	129 Å²	129	138.5 Å²	138.5	90%	0.902	81%	0.808	S	S	*	*			trans	-154	101.9	158.8	-86.6	0	0	0	0	112.7
255	A	31.6	Very low	30.2	Very low	92 Å²	92	136.3 Å²	136.3	76%	0.76	80%	0.802	S	S	*	*			trans	-167.1	150.6	165.1	0	0	0	0	0	106.1
256	L	29.6	Very low	30.3	Very low	170 Å²	170	139.3 Å²	139.3	89%	0.89	80%	0.798	S	S	*	*			cis	-132.8	149.4	32.1	-72.2	159.4	0	0	0	113.3
257	A	28.1	Very low	30.5	Very low	101 Å²	101	135.3 Å²	135.3	84%	0.835	79%	0.794	S	S	*	*			trans	-92.3	166.8	149.5	0	0	0	0	0	108.6
258	G	30.3	Very low	30.5	Very low	63 Å²	63	132 Å²	132	65%	0.649	79%	0.788	S	S	*	*			cis	156.8	-174.9	2	0	0	0	0	0	109.8
259	Q	32.1	Very low	30.7	Very low	188 Å²	188	131.6 Å²	131.6	88%	0.879	79%	0.79	S	S	*	*			trans	71.6	146.6	-179.9	-45.3	-180	11.5	0	0	113.1
260	L	26.8	Very low	31	Very low	156 Å²	156	132.7 Å²	132.7	82%	0.817	79%	0.794	S	S	*	*			cis	-147.2	158	41.9	-79.8	160.7	0	0	0	114.6
261	A	28.3	Very low	30.9	Very low	94 Å²	94	129.5 Å²	129.5	78%	0.777	79%	0.79	S	S	*	*			trans	43.1	129.9	147	0	0	0	0	0	123.5
262	S	32.7	Very low	30.9	Very low	118 Å²	118	128 Å²	128	83%	0.825	79%	0.79	S	S	*	*			trans	-69.4	171.1	160.6	-17.9	0	0	0	0	112.2
263	P	35.8	Very low	30.6	Very low	125 Å²	125	124.3 Å²	124.3	81%	0.812	79%	0.785	S	S	*	*			cis	-143.7	-165.9	44.8	42.8	-21.7	0	0	0	117.2
264	L	30.9	Very low	30.4	Very low	142 Å²	142	123.6 Å²	123.6	74%	0.743	78%	0.782	S	S	*	*			trans	-60.9	164	179.3	-145.5	77.2	0	0	0	114	E266	L264-E266 HydrophobicContact CD2-CG 3.88Å
265	P	36	Very low	30.4	Very low	120 Å²	120	127.9 Å²	127.9	78%	0.779	78%	0.778	S	S	*	*				-139.5	161.6	95.7	39.6	-28.8	0	0	0	115.6
266	E	29.8	Very low	30.3	Very low	131 Å²	131	132.8 Å²	132.8	61%	0.612	79%	0.785	S	S	*	*			trans	-72.2	174.2	167	-56.8	-175	131.5	0	0	111.9	L264 Q268	L264-E266 HydrophobicContact CD2-CG 3.88Å; E266-Q268 WeakPolarHBondContact OE2-CG 3.21Å
267	P	32.8	Very low	30.3	Very low	133 Å²	133	129.1 Å²	129.1	86%	0.864	77%	0.774	S	S	*	*				-127.1	145.4	115.6	35.5	-30.3	0	0	0	114.3
268	Q	28.5	Very low	30.3	Very low	160 Å²	160	131.5 Å²	131.5	75%	0.748	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-81	159.1	-165.5	-63.6	172.3	-17.3	0	0	115.1	E266	E266-Q268 WeakPolarHBondContact OE2-CG 3.21Å
269	S	31.7	Very low	30.2	Very low	107 Å²	107	134.4 Å²	134.4	75%	0.748	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-77.2	137.8	155.1	54.8	0	0	0	0	111.4
270	P	32.8	Very low	30	Very low	129 Å²	129	132.2 Å²	132.2	84%	0.838	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-68.1	142.8	169	-18	31.9	0	0	0	112.7
271	A	25.4	Very low	30.1	Very low	86 Å²	86	133.3 Å²	133.3	71%	0.711	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-91.7	136.2	171.7	0	0	0	0	0	109.5
272	S	29.3	Very low	30.1	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	77%	0.774	S	S	*	*				90.9	174.7	90.1	76.2	0	0	0	0	114.4
273	S	27.8	Very low	30.7	Very low	103 Å²	103	137 Å²	137	72%	0.72	77%	0.767	S	S	*	*			trans	71.8	140.2	-174.5	-78.3	0	0	0	0	115.8
274	D	26.8	Very low	30.2	Very low	138 Å²	138	138.3 Å²	138.3	74%	0.738	77%	0.765	S	S	*	*			cis	-147.5	-176.6	-3	-131.9	-61.1	0	0	0	114.5
275	R	32.6	Very low	30.1	Very low	220 Å²	220	139 Å²	139	83%	0.83	77%	0.769	S	S	*	*			trans	-84.1	176.7	-169.4	-57.6	174.9	72.1	176.2	3.2	113.9
276	Q	28.2	Very low	29.5	Very low	194 Å²	194	138.6 Å²	138.6	91%	0.907	76%	0.764	S	S	*	*			trans	93.7	154.9	165.7	-54.1	174.9	2.9	0	0	116.2
277	S	29.1	Very low	29.4	Very low	94 Å²	94	140.7 Å²	140.7	66%	0.657	77%	0.774	S	S	*	*			cis	173	123.5	-46.1	164.9	0	0	0	0	109.6
278	L	29.4	Very low	29.3	Very low	150 Å²	150	143.2 Å²	143.2	79%	0.785	77%	0.774	S	S	*	*			trans	66.6	148.2	162.4	-68.2	167.4	0	0	0	119.4
279	T	27.3	Very low	29.2	Very low	125 Å²	125	141.4 Å²	141.4	77%	0.767	77%	0.773	S	S	*	*			trans	60.4	143.7	154.5	48.1	0	0	0	0	119.4
280	D	28.1	Very low	28.9	Very low	142 Å²	142	140.6 Å²	140.6	76%	0.759	77%	0.773	S	S	*	*			cis	-163.7	-163.2	-25.8	-144.4	-46.6	0	0	0	107.6
281	E	28.5	Very low	28.6	Very low	178 Å²	178	140.9 Å²	140.9	83%	0.832	77%	0.772	S	S	*	*			trans	78.8	125.5	165.5	-62.4	-76.2	62	0	0	118.2
282	K	29.5	Very low	28.7	Very low	186 Å²	186	143 Å²	143	81%	0.809	78%	0.781	S	S	*	*			trans	-108.1	-158	173.3	-129.2	-172.9	174.1	179.4	0	106.3
283	P	44.3	Very low	28.7	Very low	103 Å²	103	142.7 Å²	142.7	67%	0.669	78%	0.779	S	S	*	*			cis	-130.6	-169.5	-16.4	33.4	-11.9	0	0	0	113.3
284	I	26.4	Very low	28.6	Very low	154 Å²	154	145.8 Å²	145.8	79%	0.79	79%	0.787	S	S	*	*			trans	151.6	128.1	138.1	-80.1	159.2	0	0	0	107.5
285	L	27.3	Very low	28.6	Very low	157 Å²	157	142.6 Å²	142.6	82%	0.822	79%	0.787	S	S	*	*			cis	-140.5	170.5	-10	-125.4	171	0	0	0	108.6
286	V	24.6	Very low	28.2	Very low	110 Å²	110	138.5 Å²	138.5	67%	0.667	79%	0.786	S	S	*	*			trans	-133.6	140.4	180	171.4	0	0	0	0	108.3
287	E	27.1	Very low	28.2	Very low	175 Å²	175	137 Å²	137	82%	0.818	78%	0.779	S	S	*	*			trans	-155	136.5	140.8	-122.5	173.1	166.9	0	0	113.6	V289	E287-V289 HydrophobicContact CG-CG2 4.15Å
288	Q	30.3	Very low	28	Very low	187 Å²	187	139.6 Å²	139.6	87%	0.874	79%	0.791	S	S	*	*			trans	-125.5	130.4	164.9	-63.1	176.4	-80.7	0	0	106.7
289	V	26.8	Very low	27.9	Very low	121 Å²	121	137.2 Å²	137.2	73%	0.733	79%	0.787	S	S	*	*			trans	-150	138.3	177.9	-168.9	0	0	0	0	108.4	E287	E287-V289 HydrophobicContact CG-CG2 4.15Å
290	A	24.8	Very low	28.9	Very low	90 Å²	90	136.9 Å²	136.9	74%	0.744	79%	0.787	S	S	*	*			cis	-161.4	178.5	-29.1	0	0	0	0	0	107.9
291	V	27.6	Very low	29.5	Very low	135 Å²	135	135.3 Å²	135.3	82%	0.818	78%	0.784	S	S	*	*			trans	-105.9	136.4	169.4	175.5	0	0	0	0	109.4
292	C	26.8	Very low	29.5	Very low	131 Å²	131	134.5 Å²	134.5	89%	0.885	78%	0.778	S	S	*	*			trans	-178.9	171	141.7	-104.3	0	0	0	0	113.1
293	S	28.8	Very low	29.4	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	77%	0.772	S	S	*	*			trans	-119.6	162.9	-162.5	-48.7	0	0	0	0	114.8
294	N	27.3	Very low	28.4	Very low	167 Å²	167	134.9 Å²	134.9	89%	0.893	77%	0.774	S	S	*	*			trans	164.5	139.2	146.4	-79.2	-25.9	0	0	0	107.1
295	G	25.1	Very low	28.7	Very low	71 Å²	71	131.7 Å²	131.7	73%	0.732	77%	0.765	S	S	*	*				92.6	126.3	55.9	0	0	0	0	0	109
296	V	25.1	Very low	29.3	Very low	134 Å²	134	129.2 Å²	129.2	81%	0.812	76%	0.759	S	S	*	*			cis	-158.9	147.7	22.3	154.2	0	0	0	0	112.3
297	Q	27.5	Very low	29.4	Very low	164 Å²	164	130.5 Å²	130.5	77%	0.766	77%	0.767	S	S	*	*			trans	21.7	138.8	157.2	-65.1	-174.5	77.5	0	0	124.6
298	T	26.4	Very low	29.4	Very low	147 Å²	147	127.5 Å²	127.5	90%	0.902	77%	0.765	S	S	*	*				-164.3	166.2	110.4	13.7	0	0	0	0	111.7
299	S	26.1	Very low	29.1	Very low	101 Å²	101	121.7 Å²	121.7	71%	0.706	76%	0.756	S	S	*	*			trans	-128.6	-160.3	-159.1	-48	0	0	0	0	114.4
300	P	48.8	Very low	29.2	Very low	118 Å²	118	124.3 Å²	124.3	77%	0.766	76%	0.759	S	S	*	*				-114.8	-161.7	-121.2	42	-21.8	0	0	0	113.3
301	P	41.7	Very low	29.2	Very low	108 Å²	108	128.7 Å²	128.7	70%	0.701	76%	0.761	S	S	*	*				-155.7	176.9	76.4	43.8	-23	0	0	0	117.9
302	K	27.5	Very low	29.1	Very low	161 Å²	161	126.9 Å²	126.9	70%	0.7	76%	0.755	S	S	*	*			trans	15.6	159.5	134.2	-59.8	179.2	155.8	-76.7	0	121.2
303	E	26.8	Very low	29	Very low	145 Å²	145	131.5 Å²	131.5	68%	0.678	76%	0.755	S	S	*	*			cis	-174.6	-173.7	-11.7	-103.1	156.5	-169	0	0	106.6
304	E	24.6	Very low	29	Very low	152 Å²	152	131.8 Å²	131.8	71%	0.71	76%	0.757	S	S	*	*			cis	-155	-168.9	5.2	-135.9	-80.2	83.2	0	0	109.6
305	S	31.4	Very low	29.5	Very low	88 Å²	88	129 Å²	129	62%	0.615	75%	0.749	S	S	*	*			trans	-81.6	-169.8	172.3	-43.5	0	0	0	0	112.4
306	P	41.1	Very low	29.4	Very low	105 Å²	105	134 Å²	134	68%	0.682	75%	0.752	S	S	*	*				-154.9	171	68.5	44	-22.8	0	0	0	118.6
307	T	26	Very low	29.4	Very low	136 Å²	136	133.7 Å²	133.7	83%	0.834	76%	0.756	S	S	*	*			trans	19.4	148.9	143.8	61.4	0	0	0	0	121.7
308	S	26.3	Very low	29.2	Very low	113 Å²	113	129 Å²	129	79%	0.79	75%	0.752	S	S	*	*			cis	-174.9	167.5	6.1	176.1	0	0	0	0	107.3
309	G	25.2	Very low	29	Very low	65 Å²	65	128.6 Å²	128.6	67%	0.67	75%	0.754	S	S	*	*			cis	150.1	-179.2	-3.9	0	0	0	0	0	113.1
310	H	28.6	Very low	28.8	Very low	175 Å²	175	126.2 Å²	126.2	81%	0.81	75%	0.745	S	S	*	*			trans	64	121.3	172.6	-77.7	-65.2	0	0	0	123.2
311	K	24.9	Very low	27.8	Very low	182 Å²	182	129.4 Å²	129.4	79%	0.791	75%	0.752	S	S	*	*			trans	67.8	105.5	138.6	-80.6	-172.5	167.5	-179.9	0	122.7
312	S	25.5	Very low	27	Very low	97 Å²	97	132.3 Å²	132.3	68%	0.678	76%	0.757	S	S	*	*				80.7	148.8	113.3	-59.7	0	0	0	0	122.4
313	Y	24.2	Very low	26.9	Very low	229 Å²	229	130.6 Å²	130.6	90%	0.898	76%	0.76	S	S	*	*			trans	89.5	120.5	169.2	-64.8	-76	0	0	0	118.8
314	S	29.3	Very low	27	Very low	109 Å²	109	130.9 Å²	130.9	76%	0.762	77%	0.766	S	S	*	*			trans	-82.6	165.1	150.4	-47.3	0	0	0	0	109.1
315	P	38	Very low	27.3	Very low	110 Å²	110	130.6 Å²	130.6	71%	0.714	77%	0.768	S	S	*	*				-147.2	170.7	90.2	41.1	-25.4	0	0	0	116.2
316	E	22.2	Very low	27.2	Very low	174 Å²	174	132.8 Å²	132.8	81%	0.813	77%	0.772	S	S	*	*			trans	20.2	123.9	136	-59.4	-177.6	129.8	0	0	119
317	S	25.7	Very low	26.4	Very low	128 Å²	128	133.4 Å²	133.4	90%	0.895	78%	0.775	S	S	*	*				82.6	133.9	71.3	-67.9	0	0	0	0	115.1
318	G	23.9	Very low	26.5	Very low	65 Å²	65	134.1 Å²	134.1	67%	0.67	77%	0.773	S	S	*	*			trans	137.8	120.6	-170.4	0	0	0	0	0	108.4
319	C	21.5	Very low	26.5	Very low	139 Å²	139	134.4 Å²	134.4	94%	0.939	77%	0.774	S	S	*	*			cis	56.7	108.7	26.3	-54.5	0	0	0	0	112.5
320	G	22.3	Very low	26.6	Very low	52 Å²	52	135 Å²	135	54%	0.536	78%	0.781	S	S	.	*			cis	171.1	-178.3	-4.4	0	0	0	0	0	111.7
321	M	26.3	Very low	26.3	Very low	184 Å²	184	132.2 Å²	132.2	91%	0.906	78%	0.781	S	S	*	*			trans	60.6	159.8	171	76.2	-104.3	172.1	0	0	116.2
322	E	25.5	Very low	26.4	Very low	170 Å²	170	130.7 Å²	130.7	79%	0.794	79%	0.786	S	S	*	*			cis	-135.2	174.7	12.7	-69.6	-174.3	127	0	0	114.1
323	T	26.6	Very low	26.5	Very low	125 Å²	125	130.7 Å²	130.7	77%	0.767	79%	0.786	S	S	*	*			trans	7.8	130.2	160.6	55.6	0	0	0	0	121
324	N	27.2	Very low	26.6	Very low	150 Å²	150	126.6 Å²	126.6	80%	0.802	78%	0.78	S	S	*	*			cis	84.1	109.6	32.5	-167.3	19.1	0	0	0	116.9
325	I	31.5	Very low	26.6	Very low	147 Å²	147	125.6 Å²	125.6	75%	0.754	77%	0.773	S	S	*	*			trans	-160.4	145	156.3	34.8	171.9	0	0	0	106.3
326	N	29	Very low	26.1	Very low	133 Å²	133	129.6 Å²	129.6	71%	0.711	78%	0.782	S	S	*	*			cis	-152.7	170.6	11.2	-100.4	-36	0	0	0	111.1
327	T	25.4	Very low	26.5	Very low	119 Å²	119	125.7 Å²	125.7	73%	0.73	78%	0.78	S	S	*	*			trans	127.1	106.4	132.6	-46.2	0	0	0	0	116.7
328	L	27.9	Very low	26.5	Very low	151 Å²	151	125.6 Å²	125.6	79%	0.791	78%	0.779	S	S	*	*			trans	35.8	119.1	151.2	-77.1	89.1	0	0	0	120.4
329	S	26.7	Very low	26.8	Very low	118 Å²	118	129 Å²	129	83%	0.825	79%	0.787	S	S	*	*				90.9	135.9	69	-66.5	0	0	0	0	113.2
330	G	25.7	Very low	27.2	Very low	78 Å²	78	128.3 Å²	128.3	80%	0.804	78%	0.781	S	S	*	*			cis	-173.7	173.8	-2.3	0	0	0	0	0	112
331	S	23.9	Very low	27.5	Very low	117 Å²	117	129.9 Å²	129.9	82%	0.818	79%	0.789	S	S	*	*			trans	-137.9	152	-177.2	52.6	0	0	0	0	112.2
332	V	26.8	Very low	27.9	Very low	149 Å²	149	127.5 Å²	127.5	90%	0.903	79%	0.787	S	S	*	*			trans	-99.2	124	-178.7	176.9	0	0	0	0	109.8
333	S	26.6	Very low	28	Very low	97 Å²	97	124 Å²	124	68%	0.678	79%	0.787	S	S	*	*			trans	-92.6	178.6	172.3	-48.7	0	0	0	0	109.7
334	N	26.8	Very low	28.1	Very low	144 Å²	144	122.3 Å²	122.3	77%	0.77	79%	0.786	S	S	*	*			cis	-165.1	-177.3	13.8	-155.1	-3.9	0	0	0	110.6
335	S	29.4	Very low	28	Very low	88 Å²	88	123 Å²	123	62%	0.615	79%	0.79	S	S	*	*			trans	74.3	151.5	154.5	-57.2	0	0	0	0	117.4
336	Q	28.3	Very low	28.1	Very low	193 Å²	193	120.3 Å²	120.3	90%	0.902	79%	0.789	S	S	*	*			cis	-150.9	175.7	-6.5	-128	171.4	-5.4	0	0	110.5
337	A	29.1	Very low	28.7	Very low	92 Å²	92	120 Å²	120	76%	0.76	79%	0.794	S	S	*	*			trans	-94.3	150.7	-172.2	0	0	0	0	0	115
338	S	26.4	Very low	28.8	Very low	126 Å²	126	118.7 Å²	118.7	88%	0.881	79%	0.79	S	S	*	*			trans	-165.8	146.6	158	-80.7	0	0	0	0	111.5
339	T	29.3	Very low	29.3	Very low	136 Å²	136	120 Å²	120	83%	0.834	79%	0.792	S	S	*	*			trans	-98.9	148.3	169.5	-24.9	0	0	0	0	109.3
340	P	30.8	Very low	29.6	Very low	125 Å²	125	120.1 Å²	120.1	81%	0.812	78%	0.784	S	S	*	*				-145.4	169.4	106	38.6	-24.6	0	0	0	114.5
341	A	28.8	Very low	30.3	Very low	86 Å²	86	126.3 Å²	126.3	71%	0.711	79%	0.792	S	S	*	*			trans	-92.3	164.8	163.8	0	0	0	0	0	110.5
342	P	35.1	Very low	30.9	Very low	133 Å²	133	126.2 Å²	126.2	86%	0.864	78%	0.779	S	S	*	*				-138	179.3	91.1	39.2	-26.9	0	0	0	114.3
343	A	27.7	Very low	31.6	Very low	97 Å²	97	124.4 Å²	124.4	80%	0.802	76%	0.764	S	S	*	*			trans	-109.8	-172.3	-177.3	0	0	0	0	0	113
344	A	27.4	Very low	32.4	Very low	90 Å²	90	127.2 Å²	127.2	74%	0.744	77%	0.771	S	S	*	*			trans	79.8	137.5	-172.4	0	0	0	0	0	114
345	N	26.2	Very low	33.4	Very low	164 Å²	164	122.5 Å²	122.5	88%	0.877	75%	0.745	S	S	*	*			cis	-123.8	156.4	16.7	-66.3	-70.4	0	0	0	114.3
346	A	32.4	Very low	34.3	Very low	90 Å²	90	122 Å²	122	74%	0.744	73%	0.733	S	S	*	*			trans	-100.1	176.7	155.7	0	0	0	0	0	108.2
347	P	41.6	Very low	34.9	Very low	126 Å²	126	120.6 Å²	120.6	82%	0.818	72%	0.719	S	S	*	*			cis	-110.5	-162.9	5.5	40.2	-23	0	0	0	111.3
348	S	27.1	Very low	35.5	Very low	92 Å²	92	118.5 Å²	118.5	64%	0.643	70%	0.698	S	S	*	*			cis	-160.4	160.1	23.8	52.9	0	0	0	0	114.6
349	E	38.6	Very low	36.5	Very low	178 Å²	178	121.6 Å²	121.6	83%	0.832	70%	0.699	S	S	*	*			trans	41.8	97.9	142.4	-63.5	173.7	167.6	0	0	119.2
350	D	33.6	Very low	37.4	Very low	122 Å²	122	123.3 Å²	123.3	65%	0.652	70%	0.697	S	S	*	*				172.4	95	103.5	-110.5	-26.3	0	0	0	111.4	Q352	D350-Q352 HydrophobicContact CB-CG 4.23Å; D350-Q352 PolarHBondContact O-N 3.25Å; D350-Q352 WeakPolarHBondContact OD1-CG 3.44Å; D350-Q352 PolarHBondContact OD1-NE2 3.34Å; D350-Q352 PolarHBondContact OD2-NE2 2.82Å
351	E	39.7	Very low	37.8	Very low	207 Å²	207	119.3 Å²	119.3	97%	0.967	67%	0.671	S	S	*	*			trans	-81.7	49.4	171.9	-152	-178.5	152.4	0	0	111.1	N353	E351-N353 PolarHBondContact O-N 3.46Å
352	Q	37.2	Very low	38.3	Very low	116 Å²	116	120.6 Å²	120.6	54%	0.542	67%	0.667	S	S	.	*			trans	-87.1	105.1	-173.9	-73.8	-165.4	42.9	0	0	112.8	D350	D350-Q352 HydrophobicContact CB-CG 4.23Å; D350-Q352 PolarHBondContact O-N 3.25Å; D350-Q352 WeakPolarHBondContact OD1-CG 3.44Å; D350-Q352 PolarHBondContact OD1-NE2 3.34Å; D350-Q352 PolarHBondContact OD2-NE2 2.82Å
353	N	40.7	Very low	38.8	Very low	111 Å²	111	118.6 Å²	118.6	59%	0.594	65%	0.648	S	S	*	*			trans	55.5	103.7	138.6	-87.5	-66.2	0	0	0	117.5	E351 L355	E351-N353 PolarHBondContact O-N 3.46Å; N353-L355 VanDerWaalsContact C-N 3.25Å; N353-L355 HydrophobicContact CB-CB 4.48Å; N353-L355 HydrophobicContact CB-CD1 3.59Å; N353-L355 HydrophobicContact CB-CG 3.76Å; N353-L355 PolarHBondContact O-N 2.79Å
354	L	44.6	Very low	39.5	Very low	156 Å²	156	121.2 Å²	121.2	82%	0.817	64%	0.637	S	S	*	*			trans	-64.3	89	152.8	-82.5	98.4	0	0	0	109.7
355	L	47.3	Very low	40.4	Very low	45 Å²	45	120.1 Å²	120.1	24%	0.236	62%	0.615	C	S	.	*			trans	-115.2	102.7	176.1	-79.8	169.1	0	0	0	109.4	N353 R364 F365	N353-L355 VanDerWaalsContact C-N 3.25Å; N353-L355 HydrophobicContact CB-CB 4.48Å; N353-L355 HydrophobicContact CB-CD1 3.59Å; N353-L355 HydrophobicContact CB-CG 3.76Å; N353-L355 PolarHBondContact O-N 2.79Å; L355-R364 HydrophobicContact CB-CB 4Å; L355-R364 HydrophobicContact CB-CG 4.23Å; L355-R364 HydrophobicContact CD1-CB 4.01Å; L355-R364 HydrophobicContact CD1-CG 4.49Å; L355-R364 HydrophobicContact CD2-CB 4.2Å; L355-R364 HydrophobicContact CG-CB 4.28Å; L355-F365 VanDerWaalsContact CD2-O 3.24Å; L355-F365 WeakPolarHBondContact CD2-O 3.23Å
356	H	49.2	Very low	41.3	Very low	78 Å²	78	115.3 Å²	115.3	36%	0.361	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-62.4	138.3	174.6	-62.2	-72.6	0	0	0	110.8	F365 Q407	H356-F365 PolarHBondContact O-N 2.84Å; H356-Q407 PolarHBondContact CD2-NE2 2.9Å; H356-Q407 PolarHBondContact CE1-NE2 2.84Å; H356-Q407 VanDerWaalsContact CE1-NE2 3.25Å; H356-Q407 PolarHBondContact ND1-NE2 3.21Å; H356-Q407 PolarHBondContact NE2-NE2 2.78Å
357	R	41.1	Very low	41.9	Very low	163 Å²	163	115.4 Å²	115.4	62%	0.615	58%	0.583	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.3	138.4	-177	-64.2	176.2	78.2	163.6	-0.1	110.8	D362 R364	R357-D362 IonicContact CZ-OD1 3.92Å; R357-D362 VanDerWaalsContact CZ-OD1 3.26Å; R357-D362 IonicContact CZ-OD2 3.26Å; R357-D362 IonicContact NE-OD1 3.73Å; R357-D362 PolarHBondContact NE-OD1 3.43Å; R357-D362 IonicContact NH2-OD1 2.98Å; R357-D362 PolarHBondContact NH2-OD1 3.07Å; R357-D362 IonicContact NH2-OD2 2.73Å; R357-D362 PolarHBondContact NH2-OD2 3.04Å; R357-R364 HydrophobicContact CG-CG 4.41Å
358	C	40.6	Very low	42	Very low	47 Å²	47	115.1 Å²	115.1	32%	0.318	57%	0.574	S	S	.	*			trans	-83.8	136.7	164.6	-176.6	0	0	0	0	109.7	H360 C361	C358-H360 VanDerWaalsContact C-N 3.31Å; C358-H360 PolarHBondContact O-N 3.05Å; C358-C361 WeakPolarHBondContact CB-O 3.27Å
359	Q	48.4	Very low	43.1	Very low	191 Å²	191	113.9 Å²	113.9	89%	0.893	56%	0.563	S	S	*	*	S	Bend	trans	-83.9	-0.8	-174.4	-138.6	171.1	20.8	0	0	114.6
360	H	47	Very low	43.6	Very low	172 Å²	172	109.4 Å²	109.4	80%	0.796	54%	0.544	S	S	*	.	S	Bend	trans	-115.8	-11.4	177.2	-70	-70.8	0	0	0	114.4	C358	C358-H360 VanDerWaalsContact C-N 3.31Å; C358-H360 PolarHBondContact O-N 3.05Å
361	C	40.4	Very low	43.8	Very low	41 Å²	41	112.7 Å²	112.7	28%	0.277	55%	0.548	S	S	.	.	S	Bend	trans	-151.5	127.7	170.8	53.5	0	0	0	0	108	C358 I363	C358-C361 WeakPolarHBondContact CB-O 3.27Å; C361-I363 HydrophobicContact CB-CD1 4.41Å; C361-I363 HydrophobicContact CB-CG1 4.47Å; C361-I363 PolarHBondContact O-N 3.09Å
362	D	39.5	Very low	44	Very low	114 Å²	114	106.8 Å²	106.8	61%	0.61	53%	0.527	S	S	*	.			trans	-81.6	41.8	-162.4	-144.8	-1.2	0	0	0	113.7	R357	R357-D362 IonicContact CZ-OD1 3.92Å; R357-D362 VanDerWaalsContact CZ-OD1 3.26Å; R357-D362 IonicContact CZ-OD2 3.26Å; R357-D362 IonicContact NE-OD1 3.73Å; R357-D362 PolarHBondContact NE-OD1 3.43Å; R357-D362 IonicContact NH2-OD1 2.98Å; R357-D362 PolarHBondContact NH2-OD1 3.07Å; R357-D362 IonicContact NH2-OD2 2.73Å; R357-D362 PolarHBondContact NH2-OD2 3.04Å
363	I	44.1	Very low	44.5	Very low	91 Å²	91	104 Å²	104	47%	0.467	52%	0.515	S	S	.	.			trans	-92.5	128.7	-176.4	-56	176.3	0	0	0	108.5	C361 F365	C361-I363 HydrophobicContact CB-CD1 4.41Å; C361-I363 HydrophobicContact CB-CG1 4.47Å; C361-I363 PolarHBondContact O-N 3.09Å; I363-F365 HydrophobicContact CB-CE2 3.96Å; I363-F365 HydrophobicContact CB-CZ 4.03Å; I363-F365 HydrophobicContact CG2-CD2 4.44Å; I363-F365 HydrophobicContact CG2-CE1 3.96Å; I363-F365 HydrophobicContact CG2-CE2 3.78Å; I363-F365 HydrophobicContact CG2-CZ 3.51Å; I363-F365 WeakPolarHBondContact O-CD2 3.2Å; I363-F365 WeakPolarHBondContact O-CE2 3.17Å
364	R	43.8	Very low	44.6	Very low	152 Å²	152	106.3 Å²	106.3	57%	0.574	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.6	-179.8	-70.9	-169.6	-74.6	171.2	-5.4	110.6	L355 R357	L355-R364 HydrophobicContact CB-CB 4Å; L355-R364 HydrophobicContact CB-CG 4.23Å; L355-R364 HydrophobicContact CD1-CB 4.01Å; L355-R364 HydrophobicContact CD1-CG 4.49Å; L355-R364 HydrophobicContact CD2-CB 4.2Å; L355-R364 HydrophobicContact CG-CB 4.28Å; R357-R364 HydrophobicContact CG-CG 4.41Å
365	F	44.4	Very low	44.2	Very low	66 Å²	66	105.8 Å²	105.8	29%	0.289	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	150.6	-176.2	-62.2	-84.4	0	0	0	113	L355 H356 I363 V369	L355-F365 VanDerWaalsContact CD2-O 3.24Å; L355-F365 WeakPolarHBondContact CD2-O 3.23Å; H356-F365 PolarHBondContact O-N 2.84Å; I363-F365 HydrophobicContact CB-CE2 3.96Å; I363-F365 HydrophobicContact CB-CZ 4.03Å; I363-F365 HydrophobicContact CG2-CD2 4.44Å; I363-F365 HydrophobicContact CG2-CE1 3.96Å; I363-F365 HydrophobicContact CG2-CE2 3.78Å; I363-F365 HydrophobicContact CG2-CZ 3.51Å; I363-F365 WeakPolarHBondContact O-CD2 3.2Å; I363-F365 WeakPolarHBondContact O-CE2 3.17Å; F365-V369 HydrophobicContact CD1-CG1 4.41Å; F365-V369 HydrophobicContact CD1-CG2 4.43Å
366	S	46.2	Very low	43.8	Very low	64 Å²	64	106.6 Å²	106.6	45%	0.448	54%	0.536	S	S	.	.			trans	-109.1	153.7	169.8	58.7	0	0	0	0	112	N368 V369	S366-N368 PolarHBondContact O-N 2.88Å; S366-V369 PolarHBondContact O-N 2.98Å
367	D	44.8	Very low	43.6	Very low	91 Å²	91	105.3 Å²	105.3	49%	0.487	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-58.8	-28.3	-157.6	-41.4	-63.3	0	0	0	114.8	V369 I370	D367-V369 PolarHBondContact O-N 3.39Å; D367-I370 WeakPolarHBondContact O-CB 3.38Å; D367-I370 PolarHBondContact O-N 3.5Å
368	N	43.1	Very low	43.3	Very low	121 Å²	121	105.7 Å²	105.7	65%	0.647	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-55.3	-22.2	176.7	-71.3	-86.5	0	0	0	113.9	S366 T372	S366-N368 PolarHBondContact O-N 2.88Å; N368-T372 PolarHBondContact O-OG1 3.12Å; N368-T372 VanDerWaalsContact O-OG1 3.07Å
369	V	50.6	Low	43.5	Very low	65 Å²	65	106.2 Å²	106.2	39%	0.394	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-74.6	-40.3	175.7	-178.6	0	0	0	0	111.4	F365 S366 D367 Y371 T372	F365-V369 HydrophobicContact CD1-CG1 4.41Å; F365-V369 HydrophobicContact CD1-CG2 4.43Å; S366-V369 PolarHBondContact O-N 2.98Å; D367-V369 PolarHBondContact O-N 3.39Å; V369-Y371 PolarHBondContact O-N 2.94Å; V369-T372 WeakPolarHBondContact O-CB 3.49Å; V369-T372 PolarHBondContact O-N 3.35Å
370	I	48.6	Very low	43.3	Very low	85 Å²	85	106.9 Å²	106.9	44%	0.436	55%	0.553	S	S	.	*	H	α-helix	trans	-60.6	-47.3	-174.3	-55.4	174.4	0	0	0	110.2	D367 T372 I373	D367-I370 WeakPolarHBondContact O-CB 3.38Å; D367-I370 PolarHBondContact O-N 3.5Å; I370-T372 PolarHBondContact O-N 3.32Å; I370-T372 VanDerWaalsContact O-N 3.16Å; I370-I373 PolarHBondContact O-N 3.31Å
371	Y	39.1	Very low	43.1	Very low	190 Å²	190	107.9 Å²	107.9	75%	0.745	56%	0.558	S	S	*	*	H	α-helix	trans	-61.4	-23.4	177.5	-122.7	-80.9	0	0	0	114	V369	V369-Y371 PolarHBondContact O-N 2.94Å
372	T	43.3	Very low	43.6	Very low	84 Å²	84	112.7 Å²	112.7	52%	0.515	58%	0.576	S	S	.	*	H	α-helix	trans	-78.9	-29.9	-178.9	-54.2	0	0	0	0	111.9	N368 V369 I370	N368-T372 PolarHBondContact O-OG1 3.12Å; N368-T372 VanDerWaalsContact O-OG1 3.07Å; V369-T372 WeakPolarHBondContact O-CB 3.49Å; V369-T372 PolarHBondContact O-N 3.35Å; I370-T372 PolarHBondContact O-N 3.32Å; I370-T372 VanDerWaalsContact O-N 3.16Å
373	I	48.8	Very low	44.4	Very low	57 Å²	57	110.5 Å²	110.5	29%	0.292	57%	0.568	S	S	.	*	H	α-helix	trans	-71.5	-37.8	178.3	-60.3	170.8	0	0	0	110.4	I370 M375 G376 F399 F403	I370-I373 PolarHBondContact O-N 3.31Å; I373-M375 PolarHBondContact O-N 3.06Å; I373-M375 VanDerWaalsContact O-N 3.11Å; I373-G376 PolarHBondContact O-N 2.86Å; I373-F399 HydrophobicContact CG2-CE1 3.89Å; I373-F399 HydrophobicContact CG2-CZ 4.02Å; I373-F403 HydrophobicContact CD1-CE1 3.78Å; I373-F403 HydrophobicContact CD1-CZ 3.86Å
374	H	41.7	Very low	44.9	Very low	160 Å²	160	108.8 Å²	108.8	74%	0.741	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-18.2	-172.9	-136.8	-73.8	0	0	0	115
375	M	35.4	Very low	45.2	Very low	145 Å²	145	107 Å²	107	71%	0.714	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-0.2	-178.5	-66.6	-54.7	-51.3	0	0	114.4	I373	I373-M375 PolarHBondContact O-N 3.06Å; I373-M375 VanDerWaalsContact O-N 3.11Å
376	G	39.9	Very low	45.7	Very low	62 Å²	62	104.1 Å²	104.1	64%	0.639	54%	0.543	S	S	*	.	S	Bend	trans	-84.8	-15.4	-176.7	0	0	0	0	0	115.8	I373 H378	I373-G376 PolarHBondContact O-N 2.86Å; G376-H378 PolarHBondContact O-N 3.04Å
377	C	44.6	Very low	45.6	Very low	51 Å²	51	109 Å²	109	35%	0.345	56%	0.564	S	S	.	*			trans	-107.4	69.8	-161.4	-59.1	0	0	0	0	113.8
378	H	35.4	Very low	45.6	Very low	171 Å²	171	108.8 Å²	108.8	79%	0.792	56%	0.562	S	S	*	*	S	Bend	trans	-118.2	115.9	163.6	-88	-93	0	0	0	110.4	G376	G376-H378 PolarHBondContact O-N 3.04Å
379	G	44.9	Very low	46	Very low	58 Å²	58	106 Å²	106	60%	0.598	55%	0.551	S	S	*	*			trans	93.4	176.9	179.5	0	0	0	0	0	115.2
380	Y	42.8	Very low	46.1	Very low	205 Å²	205	104.6 Å²	104.6	80%	0.804	55%	0.551	S	S	*	*			trans	79.1	129.4	173.6	-45.8	-69.4	0	0	0	117.6	H382	Y380-H382 PolarHBondContact O-N 3.1Å
381	E	43.9	Very low	46.4	Very low	193 Å²	193	105.8 Å²	105.8	90%	0.902	55%	0.554	S	S	*	*	S	Bend	trans	-98.1	41.4	-173.3	-56.9	-179.2	132.8	0	0	111.8
382	H	50.3	Low	47.2	Very low	142 Å²	142	102.1 Å²	102.1	66%	0.657	55%	0.545	S	S	*	.	S	Bend	trans	-131.1	148.8	-169.7	-67.4	-13.2	0	0	0	111.8	Y380 F384	Y380-H382 PolarHBondContact O-N 3.1Å; H382-F384 PolarHBondContact O-N 2.79Å
383	P	56	Low	48.1	Very low	67 Å²	67	98.3 Å²	98.3	44%	0.435	52%	0.522	S	S	.	.			trans	-61.7	132.4	-178.8	25	-34.4	0	0	0	111.6	Q385 M392 C393	P383-Q385 PolarHBondContact O-N 3.34Å; P383-Q385 VanDerWaalsContact O-N 3.11Å; P383-M392 HydrophobicContact CB-CE 4.35Å; P383-M392 HydrophobicContact CG-CE 3.92Å; P383-C393 CarbonylContact C-O 3.56Å
384	F	55.7	Low	48.5	Very low	56 Å²	56	102.7 Å²	102.7	25%	0.246	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	98.4	-175.8	-61.2	-89.6	0	0	0	110.4	H382 C386 C393 K396 F399	H382-F384 PolarHBondContact O-N 2.79Å; F384-C386 PolarHBondContact O-N 2.84Å; F384-C393 HydrophobicContact CB-CB 4.26Å; F384-C393 PolarHBondContact N-O 2.98Å; F384-C393 PolarHBondContact O-N 3.47Å; F384-K396 HydrophobicContact CE2-CB 4.24Å; F384-K396 HydrophobicContact CZ-CB 4.39Å; F384-F399 HydrophobicContact CB-CD2 4.11Å
385	Q	50.3	Low	49.1	Very low	114 Å²	114	98 Å²	98	53%	0.533	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	124.4	170.7	-163.7	174.3	30.5	0	0	110.8	P383 N387 G390 H391 M392	P383-Q385 PolarHBondContact O-N 3.34Å; P383-Q385 VanDerWaalsContact O-N 3.11Å; Q385-N387 PolarHBondContact O-N 3.33Å; Q385-G390 WeakPolarHBondContact CG-O 3.31Å; Q385-G390 PolarHBondContact NE2-O 3.32Å; Q385-H391 WeakPolarHBondContact CA-O 3.25Å; Q385-M392 HydrophobicContact CB-CG 4.48Å; Q385-M392 HydrophobicContact CG-CG 4.29Å
386	C	54.3	Low	49.9	Very low	5 Å²	5	97.6 Å²	97.6	3%	0.034	52%	0.519	C	S	.	.			trans	-73.3	109.5	174.5	-178.3	0	0	0	0	110.4	F384 I388 C389 G390 H391 F399	F384-C386 PolarHBondContact O-N 2.84Å; C386-I388 PolarHBondContact O-N 3.31Å; C386-C389 VanDerWaalsContact CB-SG 3.52Å; C386-C389 PolarHBondContact O-N 2.86Å; C386-C389 PolarHBondContact SG-SG 3.09Å; C386-G390 WeakPolarHBondContact O-CA 3.39Å; C386-G390 PolarHBondContact O-N 2.61Å; C386-H391 PolarHBondContact N-O 3.36Å; C386-F399 HydrophobicContact CB-CE2 4.45Å
387	N	44.2	Very low	50.7	Low	166 Å²	166	103.7 Å²	103.7	89%	0.888	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	5.4	178.9	-69.2	-42.4	0	0	0	115.6	Q385	Q385-N387 PolarHBondContact O-N 3.33Å
388	I	45.6	Very low	51.2	Low	87 Å²	87	105.4 Å²	105.4	45%	0.446	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112	-41.3	178.4	-56.2	176.1	0	0	0	111.3	C386	C386-I388 PolarHBondContact O-N 3.31Å
389	C	50.2	Low	52.2	Low	62 Å²	62	99.1 Å²	99.1	42%	0.419	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-0.4	-175.2	65.1	0	0	0	0	114.5	C386 H391 H402	C386-C389 VanDerWaalsContact CB-SG 3.52Å; C386-C389 PolarHBondContact O-N 2.86Å; C386-C389 PolarHBondContact SG-SG 3.09Å; C389-H391 PolarHBondContact O-N 2.75Å; C389-H391 VanDerWaalsContact O-N 3.1Å; C389-H402 PolarHBondContact SG-NE2 2.89Å; C389-H402 VanDerWaalsContact SG-NE2 3.36Å
390	G	52.7	Low	52.6	Low	37 Å²	37	99.1 Å²	99.1	38%	0.381	49%	0.494	S	S	.	.			trans	72.3	-6.8	-179.5	0	0	0	0	0	115.5	Q385 C386	Q385-G390 WeakPolarHBondContact CG-O 3.31Å; Q385-G390 PolarHBondContact NE2-O 3.32Å; C386-G390 WeakPolarHBondContact O-CA 3.39Å; C386-G390 PolarHBondContact O-N 2.61Å
391	H	54.8	Low	53.1	Low	109 Å²	109	91.7 Å²	91.7	51%	0.505	47%	0.472	S	S	.	.			trans	-65.5	135.2	-177.2	-171.7	69.1	0	0	0	112	Q385 C386 C389	Q385-H391 WeakPolarHBondContact CA-O 3.25Å; C386-H391 PolarHBondContact N-O 3.36Å; C389-H391 PolarHBondContact O-N 2.75Å; C389-H391 VanDerWaalsContact O-N 3.1Å
392	M	57.2	Low	53.7	Low	113 Å²	113	86 Å²	86	56%	0.557	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	102.3	-178.6	-68.5	168.2	62	0	0	110.5	P383 Q385	P383-M392 HydrophobicContact CB-CE 4.35Å; P383-M392 HydrophobicContact CG-CE 3.92Å; Q385-M392 HydrophobicContact CB-CG 4.48Å; Q385-M392 HydrophobicContact CG-CG 4.29Å
393	C	61.4	Low	53.8	Low	4 Å²	4	83.2 Å²	83.2	3%	0.027	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	122.1	171.8	-64.3	0	0	0	0	109.6	P383 F384 D395 N398 F399	P383-C393 CarbonylContact C-O 3.56Å; F384-C393 HydrophobicContact CB-CB 4.26Å; F384-C393 PolarHBondContact N-O 2.98Å; F384-C393 PolarHBondContact O-N 3.47Å; C393-D395 PolarHBondContact O-N 3.49Å; C393-N398 HydrophobicContact CB-CB 3.99Å; C393-F399 HydrophobicContact CB-CB 4.05Å
394	I	56.5	Low	53.6	Low	149 Å²	149	83 Å²	83	76%	0.764	44%	0.436	S	S	*	.	S	Bend	trans	-66.7	-27.7	-174.3	-58.7	173.9	0	0	0	111.8
395	D	54.6	Low	53.1	Low	63 Å²	63	90.6 Å²	90.6	34%	0.337	46%	0.462	S	S	.	.	S	Bend	trans	-140.9	175.9	177.5	68.4	16.3	0	0	0	113.3	C393 Y397 N398 F399	C393-D395 PolarHBondContact O-N 3.49Å; D395-Y397 VanDerWaalsContact C-N 3.29Å; D395-Y397 PolarHBondContact O-N 2.74Å; D395-Y397 PolarHBondContact OD1-N 3.13Å; D395-Y397 VanDerWaalsContact OD1-N 3.13Å; D395-N398 VanDerWaalsContact OD1-CB 3.31Å; D395-N398 WeakPolarHBondContact OD1-CB 3.48Å; D395-N398 PolarHBondContact OD1-N 3.42Å; D395-N398 PolarHBondContact OD1-ND2 3.05Å; D395-F399 PolarHBondContact O-N 2.92Å
396	K	53.3	Low	53.1	Low	136 Å²	136	87.6 Å²	87.6	59%	0.591	46%	0.462	S	S	*	.	H	α-helix	trans	-65.2	-29.1	178.6	-175.3	175.2	178.7	175.5	0	113	F384 A400	F384-K396 HydrophobicContact CE2-CB 4.24Å; F384-K396 HydrophobicContact CZ-CB 4.39Å; K396-A400 PolarHBondContact O-N 3.5Å; K396-A400 VanDerWaalsContact O-N 3.09Å
397	Y	56	Low	52.8	Low	190 Å²	190	92.1 Å²	92.1	75%	0.745	48%	0.483	S	S	*	.	H	α-helix	trans	-76.7	-39	-178	-69	-74.8	0	0	0	112	D395 F399 A400 C401	D395-Y397 VanDerWaalsContact C-N 3.29Å; D395-Y397 PolarHBondContact O-N 2.74Å; D395-Y397 PolarHBondContact OD1-N 3.13Å; D395-Y397 VanDerWaalsContact OD1-N 3.13Å; Y397-F399 VanDerWaalsContact C-N 3.35Å; Y397-A400 PolarHBondContact O-N 3.24Å; Y397-C401 VanDerWaalsContact O-CB 3.23Å; Y397-C401 WeakPolarHBondContact O-CB 3.44Å; Y397-C401 PolarHBondContact O-N 3.33Å
398	N	54.2	Low	52.4	Low	87 Å²	87	93.2 Å²	93.2	47%	0.465	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-40.6	171.7	-80.7	-80.1	0	0	0	111.3	C393 D395 C401 H402	C393-N398 HydrophobicContact CB-CB 3.99Å; D395-N398 VanDerWaalsContact OD1-CB 3.31Å; D395-N398 WeakPolarHBondContact OD1-CB 3.48Å; D395-N398 PolarHBondContact OD1-N 3.42Å; D395-N398 PolarHBondContact OD1-ND2 3.05Å; N398-C401 PolarHBondContact O-N 2.85Å; N398-H402 WeakPolarHBondContact O-CB 3.17Å; N398-H402 PolarHBondContact O-N 2.79Å
399	F	56.8	Low	51.8	Low	39 Å²	39	98.9 Å²	98.9	17%	0.171	50%	0.504	C	S	.	.	H	α-helix	trans	-61.5	-47.4	174.2	-171	-93.4	0	0	0	111.5	I373 F384 C386 C393 D395 Y397 C401 H402 F403	I373-F399 HydrophobicContact CG2-CE1 3.89Å; I373-F399 HydrophobicContact CG2-CZ 4.02Å; F384-F399 HydrophobicContact CB-CD2 4.11Å; C386-F399 HydrophobicContact CB-CE2 4.45Å; C393-F399 HydrophobicContact CB-CB 4.05Å; D395-F399 PolarHBondContact O-N 2.92Å; Y397-F399 VanDerWaalsContact C-N 3.35Å; F399-C401 PolarHBondContact O-N 2.93Å; F399-H402 PolarHBondContact O-N 3.1Å; F399-F403 HydrophobicContact CD1-CD2 4.35Å; F399-F403 HydrophobicContact CD1-CE2 4.43Å; F399-F403 HydrophobicContact CE1-CD2 4.04Å; F399-F403 AromaticContact CE1-CE2 3.77Å; F399-F403 HydrophobicContact CE1-CE2 3.77Å; F399-F403 AromaticContact CE2-CE2 3.94Å; F399-F403 HydrophobicContact CE2-CE2 3.94Å; F399-F403 HydrophobicContact CZ-CD2 4.21Å; F399-F403 AromaticContact CZ-CE2 3.5Å; F399-F403 HydrophobicContact CZ-CE2 3.5Å; F399-F403 VanDerWaalsContact CZ-CE2 3.5Å; F399-F403 HydrophobicContact CZ-CZ 4.29Å; F399-F403 WeakPolarHBondContact O-CD2 3.36Å; F399-F403 PolarHBondContact O-N 3.13Å
400	A	54	Low	51	Low	57 Å²	57	109.5 Å²	109.5	47%	0.471	54%	0.543	S	S	.	.	H	α-helix	trans	-61.5	-41.9	175	0	0	0	0	0	112.6	K396 Y397 H402 F403 A404	K396-A400 PolarHBondContact O-N 3.5Å; K396-A400 VanDerWaalsContact O-N 3.09Å; Y397-A400 PolarHBondContact O-N 3.24Å; A400-H402 PolarHBondContact O-N 2.66Å; A400-F403 PolarHBondContact O-N 3Å; A400-A404 WeakPolarHBondContact O-CB 3.45Å; A400-A404 PolarHBondContact O-N 2.96Å
401	C	52.1	Low	51	Low	49 Å²	49	113.1 Å²	113.1	33%	0.331	55%	0.551	S	S	.	*	H	α-helix	trans	-64.7	-37.2	177.5	-174	0	0	0	0	112.6	Y397 N398 F399 F403 A404 R405	Y397-C401 VanDerWaalsContact O-CB 3.23Å; Y397-C401 WeakPolarHBondContact O-CB 3.44Å; Y397-C401 PolarHBondContact O-N 3.33Å; N398-C401 PolarHBondContact O-N 2.85Å; F399-C401 PolarHBondContact O-N 2.93Å; C401-F403 VanDerWaalsContact C-N 3.32Å; C401-F403 PolarHBondContact O-N 2.85Å; C401-A404 PolarHBondContact O-N 3.35Å; C401-R405 WeakPolarHBondContact O-CB 3.46Å; C401-R405 WeakPolarHBondContact O-CG 3.14Å; C401-R405 PolarHBondContact O-N 3.05Å
402	H	56.9	Low	50.8	Low	75 Å²	75	113.3 Å²	113.3	35%	0.347	55%	0.553	S	S	.	*	H	α-helix	trans	-62.2	-38.8	176.3	-174.4	45.5	0	0	0	111.9	C389 N398 F399 A400	C389-H402 PolarHBondContact SG-NE2 2.89Å; C389-H402 VanDerWaalsContact SG-NE2 3.36Å; N398-H402 WeakPolarHBondContact O-CB 3.17Å; N398-H402 PolarHBondContact O-N 2.79Å; F399-H402 PolarHBondContact O-N 3.1Å; A400-H402 PolarHBondContact O-N 2.66Å
403	F	53	Low	50.4	Low	82 Å²	82	113.3 Å²	113.3	36%	0.36	55%	0.553	S	S	.	*	H	α-helix	trans	-75.4	-43	172.6	-82.3	-93.7	0	0	0	112.8	I373 F399 A400 C401 R405 G406	I373-F403 HydrophobicContact CD1-CE1 3.78Å; I373-F403 HydrophobicContact CD1-CZ 3.86Å; F399-F403 HydrophobicContact CD1-CD2 4.35Å; F399-F403 HydrophobicContact CD1-CE2 4.43Å; F399-F403 HydrophobicContact CE1-CD2 4.04Å; F399-F403 AromaticContact CE1-CE2 3.77Å; F399-F403 HydrophobicContact CE1-CE2 3.77Å; F399-F403 AromaticContact CE2-CE2 3.94Å; F399-F403 HydrophobicContact CE2-CE2 3.94Å; F399-F403 HydrophobicContact CZ-CD2 4.21Å; F399-F403 AromaticContact CZ-CE2 3.5Å; F399-F403 HydrophobicContact CZ-CE2 3.5Å; F399-F403 VanDerWaalsContact CZ-CE2 3.5Å; F399-F403 HydrophobicContact CZ-CZ 4.29Å; F399-F403 WeakPolarHBondContact O-CD2 3.36Å; F399-F403 PolarHBondContact O-N 3.13Å; A400-F403 PolarHBondContact O-N 3Å; C401-F403 VanDerWaalsContact C-N 3.32Å; C401-F403 PolarHBondContact O-N 2.85Å; F403-R405 VanDerWaalsContact C-N 3.34Å; F403-R405 PolarHBondContact O-N 3.31Å; F403-G406 PolarHBondContact O-N 3.12Å
404	A	50.9	Low	49.7	Very low	64 Å²	64	119.8 Å²	119.8	53%	0.529	58%	0.584	S	S	.	*	H	α-helix	trans	-61.7	-38.4	-179.4	0	0	0	0	0	112.8	A400 C401 G406 Q407	A400-A404 WeakPolarHBondContact O-CB 3.45Å; A400-A404 PolarHBondContact O-N 2.96Å; C401-A404 PolarHBondContact O-N 3.35Å; A404-G406 PolarHBondContact O-N 2.94Å; A404-G406 VanDerWaalsContact O-N 3.12Å; A404-Q407 PolarHBondContact O-N 3.48Å
405	R	46.9	Very low	49.3	Very low	214 Å²	214	117.9 Å²	117.9	81%	0.808	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-11.5	173.9	-79.2	178	160.4	162.6	-5	114	C401 F403 Q407	C401-R405 WeakPolarHBondContact O-CB 3.46Å; C401-R405 WeakPolarHBondContact O-CG 3.14Å; C401-R405 PolarHBondContact O-N 3.05Å; F403-R405 VanDerWaalsContact C-N 3.34Å; F403-R405 PolarHBondContact O-N 3.31Å; R405-Q407 VanDerWaalsContact C-N 3.33Å
406	G	49.3	Very low	49	Very low	52 Å²	52	121.6 Å²	121.6	54%	0.536	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.4	-10.2	170.6	0	0	0	0	0	114.9	F403 A404	F403-G406 PolarHBondContact O-N 3.12Å; A404-G406 PolarHBondContact O-N 2.94Å; A404-G406 VanDerWaalsContact O-N 3.12Å
407	Q	48.1	Very low	48.7	Very low	100 Å²	100	120.6 Å²	120.6	47%	0.467	59%	0.588	S	S	.	*	S	Bend	trans	-128.3	84.5	179.6	-69.6	-157.7	-7.9	0	0	112.8	H356 A404 R405	H356-Q407 PolarHBondContact CD2-NE2 2.9Å; H356-Q407 PolarHBondContact CE1-NE2 2.84Å; H356-Q407 VanDerWaalsContact CE1-NE2 3.25Å; H356-Q407 PolarHBondContact ND1-NE2 3.21Å; H356-Q407 PolarHBondContact NE2-NE2 2.78Å; A404-Q407 PolarHBondContact O-N 3.48Å; R405-Q407 VanDerWaalsContact C-N 3.33Å
408	H	36.4	Very low	48.1	Very low	188 Å²	188	115.2 Å²	115.2	87%	0.87	58%	0.576	S	S	*	*			trans	-165.8	106.5	149.4	-94.9	-58.4	0	0	0	111
409	K	32.6	Very low	47.6	Very low	206 Å²	206	117.6 Å²	117.6	90%	0.896	59%	0.585	S	S	*	*			trans	-164.2	98.9	151.6	-116.9	171.8	-172.2	177.7	0	111.9
410	K	34.1	Very low	46.8	Very low	285 Å²	285	124.7 Å²	124.7	100%	1.239	62%	0.623	S	S	*	*			trans	53.1	0	174.6	-64.6	-168.1	174.2	-171.9	0	114.4

Retrieved 410 of 410 residues in 46.9 ms (Link to these results)

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